| SpectraBase Spectrum ID |
EoYC5SsaUjw |
| Name |
2,3-Dimethyl-1-phenyl-2-octene |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
216.187800773 u |
| Formula |
C16H24 |
| InChI |
InChI=1S/C16H24/c1-4-5-7-10-14(2)15(3)13-16-11-8-6-9-12-16/h6,8-9,11-12H,4-5,7,10,13H2,1-3H3/b15-14- |
| InChIKey |
JBRKCVJQDVHNLF-PFONDFGASA-N |
| Molecular Weight |
216.368 g/mol |
| SMILES |
C(\C(=C/(CCCCC)C)C)C=1C=CC=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.981481 |
