| SpectraBase Spectrum ID |
2lQiWBCkh1c |
| Name |
Cumol |
| CAS Registry Number |
98-82-8 |
| Classification |
Pharmaceutical ingredient |
| Comments |
Spectrum verified by crosschecking against external libraries (five 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 |
120.093900386 u |
| Formula |
C9H12 |
| InChI |
InChI=1S/C9H12/c1-8(2)9-6-4-3-5-7-9/h3-8H,1-2H3 |
| InChIKey |
RWGFKTVRMDUZSP-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
120.195 g/mol |
| Nominal Mass |
120 u |
| Quality |
976 |
| Retention Index |
885 |
| SMILES |
C=1(C(C)C)C=CC=CC1 |
| SPLASH |
splash10-0a4i-4900000000-442e1012b6c5f9557bb7 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
(1-Methylethyl)benzene
Isopropylbenzene |
| Technique |
GC/MS |
| Wiley ID |
DD2024_000830 |
