| SpectraBase Spectrum ID |
JEjRn7k6Qvw |
| Name |
Benzhydrol |
| CAS Registry Number |
91-01-0 |
| Classification |
Pharmaceutical drug metabolite |
| Comments |
Spectrum verified by crosschecking against external libraries (four 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 |
184.088815005 u |
| Formula |
C13H12O |
| InChI |
InChI=1S/C13H12O/c14-13(11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10,13-14H |
| InChIKey |
QILSFLSDHQAZET-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
184.238 g/mol |
| Nominal Mass |
184 u |
| Quality |
979 |
| Retention Index |
1395 |
| SMILES |
OC(C=1C=CC=CC1)C1=CC=CC=C1 |
| SPLASH |
splash10-056r-6900000000-4ef333c80d7d08f5bf17 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Diphenhydramine HY
Diphenylcarbinol
Diphenylmethanol |
| Technique |
GC/MS |
| Wiley ID |
DD2024_009873 |
