| SpectraBase Spectrum ID |
5Sv0FfWlKu5 |
| Name |
Chlordiazepoxide |
| CAS Registry Number |
58-25-3 |
| Classification |
Tranquilizer |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
299.082539782 u |
| Formula |
C16H14ClN3O |
| InChI |
InChI=1S/C16H14ClN3O/c1-18-15-10-20(21)16(11-5-3-2-4-6-11)13-9-12(17)7-8-14(13)19-15/h2-9H,10H2,1H3,(H,18,19) |
| InChIKey |
ANTSCNMPPGJYLG-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
299.761 g/mol |
| SMILES |
CNC=1C[N+](=C(c2ccccc2)c2cc(Cl)ccc2N1)[O-] |
| SPLASH |
splash10-001i-3490000000-612dc99fcb6a703298eb |
| Sample Comments |
The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database. |
| Sample Preparation Procedure |
Detected: P G |
| Source of Spectrum |
H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany |
| Technique |
GC/MS |
| Wiley ID |
MMPW6e_431 |
