| SpectraBase Spectrum ID |
KfMqPzrA2ln |
| Name |
Mequitazine-M (HO-sulfoxide) AC |
| Classification |
Antihistamine |
| Comments |
Structure comment: Wiggly bond = unknown position of substituent |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
396.150763812 u |
| Formula |
C22H24N2O3S |
| InChI |
InChI=1S/C22H24N2O3S/c1-15(25)27-18-6-7-22-20(12-18)24(19-4-2-3-5-21(19)28(22)26)14-17-13-23-10-8-16(17)9-11-23/h2-7,12,16-17H,8-11,13-14H2,1H3 |
| InChIKey |
MOKLIAUAIVEGKY-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
396.505 g/mol |
| SMILES |
c12c(N(CC3CN4CCC3CC4)c3ccccc3S2=O)cc(cc1)OC(C)=O |
| SPLASH |
splash10-00di-2901000000-7980226b28d9da975964 |
| 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_1672 |
