| SpectraBase Spectrum ID |
28DT2c5mGUM |
| Name |
Clotiapine-M (nor-HO-) 2AC |
| Classification |
Neuroleptic |
| Comments |
Structure comment: Wiggly bond = unknown position of substituent |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
429.091390387 u |
| Formula |
C21H20ClN3O3S |
| InChI |
InChI=1S/C21H20ClN3O3S/c1-13(26)24-7-9-25(10-8-24)21-17-11-15(22)3-6-19(17)29-20-12-16(28-14(2)27)4-5-18(20)23-21/h3-6,11-12H,7-10H2,1-2H3 |
| InChIKey |
FUDNPIDDNFOMCM-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
429.922 g/mol |
| SMILES |
c1(cc2c(N=C(c3c(S2)ccc(c3)Cl)N2CCN(CC2)C(C)=O)cc1)OC(C)=O |
| SPLASH |
splash10-0ufr-0069200000-3d2feebbc2ae5a4f4e96 |
| 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_2376 |
