| SpectraBase Spectrum ID |
8DkSjNfPB2W |
| Name |
Cyclohexanecarbonitrile, 4-(1,1-dimethylethyl)-1-(1-methylethenyl)-, cis- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
205.183049745 u |
| Formula |
C14H23N |
| InChI |
InChI=1S/C14H23N/c1-11(2)14(10-15)8-6-12(7-9-14)13(3,4)5/h12H,1,6-9H2,2-5H3/t12-,14- |
| InChIKey |
JFVDVGHBEUGMNZ-MQMHXKEQSA-N |
| Molecular Weight |
205.345 g/mol |
| SMILES |
[C@]1(C#N)(C(=C)C)CC[C@@](C(C)(C)C)(CC1)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.823803 |
