Question

Please determine the IDENTITY of the unknown compound and explain how each peak / data point from the following instruments led to that identification. What does the gcms indicate. Thank you very much! (The GCMS data is just a long set of numbers which is why the question appears so long).

IR of unknown:

2000 Wavenumber cm-1 3500 3000 2500 1500 1000 Page 1 of 1

NMR unknown Proton Graphs (first is overall graph, others that follow are zoomed in sections):


NMR unknown Carbon Graphs (first is overall graph, others that follow are zoomed in sections):

GC/MS:

Scan 779 (9.910 min):
50.1 471296
51 307072
52 55728
53 14734
54.1 1950
55.6 9285
56.1 11179
57 5281
58.7 859
60 22792
61 62344
62 45040
63 42648
64 3236
65.1 1080
66 1290
66.9 479
68 510
69.5 5938
70.3 2657
70.8 2578
71.1 2558
72 22984
73 128504
74 418560
75 735232
76.1 204416
77.1 421696
78 28336
79.1 1815
80 342
80.9 662
81.8 405
83.1 3278
84 52520
85 118312
86 41520
87 42632
88 6848
89.1 11487
90 1273
91.1 1290
91.9 597
92.9 586
94.3 647
94.9 1172
96 2452
97 6826
98 1586
99 2493
99.7 290
101 2090
102 719
103 4172
104 33456
105.1 6865
105.9 785
106.1 742
106.9 922
108 7934
109 5270
110.1 31304
111 1733632
112 293248
113 601984
114 94688
115 5098
115.9 490
116.6 294
116.9 323
117.3 217
118.2 306
118.9 517
119.3 478
119.8 531
120.1 436
120.8 413
122 625
122.9 1709
124.1 644
124.9 820
126 549
126.5 259
127.1 273
127.9 341
129.2 601
129.8 225
130.5 176
131.3 702
131.9 387
132.4 246
133 260
133.3 244
133.9 467
134.5 264
135.3 354
136 380
137.3 1347
138.1 11128
139 4053504
140 2842624
141 1538048
142 945984
143 66432
144.1 4622
145.1 566
145.7 233
146.1 326
147 333
147.7 216
148.4 247
149 136
150.3 115
151.1 186
151.9 1430
152.9 141
154.2 204
154.7 208
155.3 295
156.6 413
157.5 135
157.9 97
158.7 343
159.1 305
160.7 413
161.5 140
162.2 301
163.1 481
164.1 182
164.8 413
166 206
166.6 126
167 122
167.7 189
168.2 296
168.7 149
169.5 206
170.5 272
171.3 228
171.8 214
172.7 193
173.3 224
174 326
174.8 431
175.4 305
176.1 94
176.7 284
177.5 248
178 151
179.1 175
179.5 198
180.1 437
180.8 396
181.1 374
182.2 339
183.1 119
183.6 84
184.3 321
185.3 369
186.3 493
187.1 144
187.9 358
188.3 148
189 317
189.6 164
190.8 359
191.4 191
192 265
192.7 231
193.2 323
193.8 270
195 243
196.2 173
196.7 22
197.6 92
198 58
198.8 126
199.9 105
200.6 194
201.9 98
202.5 323
203.1 367
203.7 168
204.1 199
205.2 287
205.6 281
206.2 167
206.9 2189
207.8 342
208.2 577
209.1 334
210.3 320
211.2 340
212.4 163
212.9 151
213.8 106
214.9 347
215.7 122
216.3 192
217.2 189
218 237
218.5 130
219.8 334
220.1 310
220.6 163
221.1 83
221.9 92
223.1 239
223.8 75
225 572
226.2 163
227.2 19
228.1 155
229 153
229.8 16
230.7 159
231.5 195
233.1 330
233.9 354
234.7 287
235.7 59
236.3 64
237 146
237.9 205
238.5 71
239 121
240.3 206
241 93
241.5 164
242.1 268
242.9 75
243.6 90
244.8 143
246.2 140
246.6 124
247.3 120
247.8 202
249.1 208
249.8 204
251.1 223
251.6 195
252.1 366
253.1 134
254.4 184
255.3 93
256.2 23
257.1 54
257.6 133
258.2 46
258.9 265
259.9 180
260.4 59
261 362
261.7 73
263 40
263.9 146
264.3 102
265.1 267
265.6 64
266.2 337
267 556
267.5 128
267.9 138
268.3 165
268.8 130
269.3 68
270.1 39
270.8 292
271.5 86
272.5 42
273 131
273.5 158
274.8 166
276 147
276.5 156
277.1 124
278.1 93
278.7 74
280 326
280.9 746
281.6 207
282.6 328
284.2 168
284.8 238
286.1 323
286.8 115
287.3 31
288.5 145
289.2 171
289.8 183
290.8 195
292.1 199
292.9 212
293.7 119
294.4 102
295.2 101
296.1 210
297.8 183
298.4 170
299.6 23
300.7 239
301.2 198
301.9 88
302.5 140
303 140
303.8 223
304.7 29
305.5 226
306.7 259
307.6 171
308.2 104
309.1 200
309.8 46
310.5 198
311.1 58
311.8 480
312.7 82
313.2 27
313.9 79
314.7 86
315.5 161
316.6 236
317.2 186
317.7 31
318.3 85
319.3 55
319.7 84
320.6 44
321.8 21
322.4 18
323.3 167
324.5 230
325.3 120
326 69
326.5 65
327 18
327.7 245
328.3 312
329 171
329.5 165
330.2 43
331 100
331.9 102
332.6 72
333 172
333.9 94
334.4 165
335.2 113
336.1 83
336.6 61
337.4 268
338.5 25
339.7 75
340.1 66
340.8 227
341.6 461
342.1 253
342.7 114
343.5 173
344 214
344.7 37
345.1 34
345.9 171
346.4 26
347.1 130
348.4 30
349.8 260
350 259
351.3 112
351.9 76
352.5 152
353.3 146
353.9 73
354.5 100
355.1 650
356 251
357.2 227
358.3 222
359 165
359.8 206
360.5 19
361.1 149
361.8 37
362.6 16
363.3 176
364.2 26
365.1 112
365.6 113
366.5 41
367 63
368.4 74
369.8 287
371.6 29
372.3 21
372.5 21
373 58
373.7 187
374.3 200
375.8 229
377.3 176
378.1 63
378.9 101
379.5 120
380.2 157
381.3 22
382.2 17
382.8 147
384 71
385 98
385.9 117
387 150
387.6 30
388.4 136
389.4 131
390.1 209
391.2 73
392 215
392.5 182
393 120
393.7 112
394 114
394.9 132
395.7 54
396.3 113
397.3 5
398 18
398.7 15
399.3 146
399.8 149
400.5 116
401.5 102
402 119
402.8 109
404 155
405.1 95
405.7 9
406.3 253
406.9 112
407.6 64
408.1 133
409.3 221
409.8 145
411.2 90
411.7 101
412.4 154
413.2 77
413.8 172
414.1 155
415.5 81
416.3 113
417 92
418.2 85
418.6 63
419.5 120
420.2 126
421.9 99
422.9 148
424 93
424.7 175
425.5 75
426.1 110
426.8 13
427.8 286
428.8 103
429.2 143
430.1 140
430.7 17
431.1 18
432.1 20
433.3 91
433.9 194
434.3 106
434.9 173
435.7 57
436 51
437 104
438.2 143
439.3 160
439.9 69
440.5 57
440.9 46
441.9 56
442.8 44
443.4 89
443.8 40
444.6 211
445.1 190
446.2 88
447 77
448.2 30
448.8 131
449.7 71
451.1 206
451.7 24
452 23
452.8 129
453.5 123
454.4 136
455.4 22
456.1 142
456.6 247
457.6 25
458.3 18
458.9 32
459.6 73
460.2 46
460.8 18
461.4 21
462 59
462.7 262
463.4 88
463.9 39
464.5 130
465.2 66
466.1 178
467 106
467.7 157
468.3 136
469.2 49
469.7 20
470.4 110
470.8 100
471.8 106
472.1 118
472.7 108
473.6 109
474.4 146
475.2 22
476 20
476.8 83
477.5 171
478 70
478.5 80
479.3 190
480.2 73
480.8 102
481.3 74
482.1 148
482.9 21
483.5 17
484.3 77
485.1 200
486.2 15
486.7 34
487.4 177
488.1 93
488.6 173
489.5 116
490.4 52
491.2 108
491.7 51
492.5 65
492.9 79
494.4 30
495.1 20
496.1 148
497.1 48
498 91
498.5 36
499.2 208
0 0
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Answer #1

Based m Spectral data tuu stvechune sould loe 13CNMR 135, อ 191.0即 1a-otpr famainin

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