| SpectraBase Spectrum ID |
BVvZTxLl0BB |
| Name |
Doxylamine-M (bis-nor-HO-) 2AC |
| Classification |
Antihistamine |
| Comments |
Structure comment: Wiggly bond = unknown position of substituent |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
342.157957192 u |
| Formula |
C19H22N2O4 |
| InChI |
InChI=1S/C19H22N2O4/c1-14(22)20-12-13-24-19(3,18-6-4-5-11-21-18)16-7-9-17(10-8-16)25-15(2)23/h4-11H,12-13H2,1-3H3,(H,20,22) |
| InChIKey |
MYCJDCSMTOKFKH-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
342.395 g/mol |
| SMILES |
c1cc(C(OCCNC(C)=O)(C)c2ccc(cc2)OC(C)=O)ncc1 |
| SPLASH |
splash10-0002-4940000000-a9ddc57f5485dc7ba913 |
| 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: UHYAC |
| 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_2696 |
