| SpectraBase Spectrum ID |
JJBJiibTU0W |
| Name |
Benproperine-M |
| CAS Registry Number |
28994-41-4 |
| Classification |
Antiseptic, Pharmaceutical drug metabolite |
| 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 |
184.088815005 u |
| Formula |
C13H12O |
| InChI |
InChI=1S/C13H12O/c14-13-9-5-4-8-12(13)10-11-6-2-1-3-7-11/h1-9,14H,10H2 |
| InChIKey |
CDMGNVWZXRKJNS-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
184.238 g/mol |
| Nominal Mass |
184 u |
| Quality |
845 |
| Retention Index |
1745 |
| SMILES |
OC1=C(CC=2C=CC=CC2)C=CC=C1 |
| SPLASH |
splash10-001i-2900000000-02cb4ed7c4b7376ac583 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
(2-Hydroxydiphenyl)methane
2-(Phenylmethyl)phenol
2-Benzylphenol |
| Technique |
GC/MS |
| Wiley ID |
DD2024_006208 |
