| SpectraBase Spectrum ID |
wKjUr9yMq |
| Name |
1-Phenyl-1-cyclohexene |
| CAS Registry Number |
771-98-2 |
| Classification |
Chemical |
| Comments |
Spectrum verified by crosschecking against external libraries (two reference spectrum with similarity >= 99% found); Spectrum verified by independent measurements in external laboratories |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
158.109550451 u |
| Formula |
C12H14 |
| InChI |
InChI=1S/C12H14/c1-3-7-11(8-4-1)12-9-5-2-6-10-12/h1,3-4,7-9H,2,5-6,10H2 |
| InChIKey |
WCMSFBRREKZZFL-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
158.244 g/mol |
| Nominal Mass |
158 u |
| Quality |
877 |
| Retention Index |
1203 |
| SMILES |
C=1(C2=CCCCC2)C=CC=CC1 |
| SPLASH |
splash10-056u-2900000000-515792941724352247a6 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
1-Cyclohexen-1-ylbenzene |
| Technique |
GC/MS |
| Wiley ID |
DD2024_018262 |
