| SpectraBase Spectrum ID |
DXajuKLht26 |
| Name |
Isothipendyl-M (nor-HO-) 2AC |
| Classification |
Antihistamine |
| Comments |
Structure comment: Wiggly bond = unknown position of substituent |
| Copyright |
Copyright © 2023-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
371.130362719 u |
| Formula |
C19H21N3O3S |
| InChI |
InChI=1S/C19H21N3O3S/c1-12(21(4)13(2)23)11-22-15-7-5-6-8-16(15)26-17-9-10-18(20-19(17)22)25-14(3)24/h5-10,12H,11H2,1-4H3 |
| InChIKey |
UPOWAFYEVVQLFQ-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
371.455 g/mol |
| SMILES |
c1ccc2N(CC(N(C(=O)C)C)C)c3c(ccc(OC(C)=O)n3)Sc2c1 |
| SPLASH |
splash10-08or-4791000000-9f9f6d8b1c13cadd0db5 |
| 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_2441 |
