| SpectraBase Spectrum ID |
BCS3qKRxLwx |
| Name |
1-Ethyl-3-vinyl-adamantane |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
190.172150708 u |
| Formula |
C14H22 |
| InChI |
InChI=1S/C14H22/c1-3-13-6-11-5-12(7-13)9-14(4-2,8-11)10-13/h3,11-12H,1,4-10H2,2H3/t11-,12+,13-,14+ |
| InChIKey |
AVRIJUMTHPONKV-KPWCQOOUSA-N |
| Molecular Weight |
190.330 g/mol |
| SMILES |
C1[C@@]2(C[C@]3(C[C@]1(C[C@](C2)(CC)C3)[H])C=C)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.932168 |
