| SpectraBase Spectrum ID |
JJOOYC8OWyu |
| Name |
Diphenhydramine |
| CAS Registry Number |
58-73-1 |
| Classification |
Pharmaceutical drug, antihistaminic |
| 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 |
255.162314299 u |
| Formula |
C17H21NO |
| InChI |
InChI=1S/C17H21NO/c1-18(2)13-14-19-17(15-9-5-3-6-10-15)16-11-7-4-8-12-16/h3-12,17H,13-14H2,1-2H3 |
| InChIKey |
ZZVUWRFHKOJYTH-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
255.361 g/mol |
| Nominal Mass |
255 u |
| Quality |
1000 |
| Retention Index |
1873 |
| SMILES |
C(C1=CC=CC=C1)(C1=CC=CC=C1)OCCN(C)C |
| SPLASH |
splash10-0a4i-9200000000-54cc86519bfbc4c31be3 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
DPH
Diphenylhydramine
2-Benzhydryloxy-N,N-dimethyl-ethanamine |
| Technique |
GC/MS |
| Wiley ID |
DD2024_019633 |
