| SpectraBase Spectrum ID |
Brt2wjbK8Xh |
| Name |
Ditazol-M (HO-) 3AC |
| Classification |
Thromb.aggr.inhib. |
| Comments |
Structure comment: Wiggly bond = unknown position of substituent |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
466.174001178 u |
| Formula |
C25H26N2O7 |
| InChI |
InChI=1S/C25H26N2O7/c1-17(28)31-15-13-27(14-16-32-18(2)29)25-26-23(20-7-5-4-6-8-20)24(34-25)21-9-11-22(12-10-21)33-19(3)30/h4-12H,13-16H2,1-3H3 |
| InChIKey |
QZFBGHSLOBNUDG-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
466.490 g/mol |
| SMILES |
c1c(ccc(c1)OC(C)=O)-c1c(nc(N(CCOC(C)=O)CCOC(C)=O)o1)-c1ccccc1 |
| SPLASH |
splash10-014r-4323900000-41cd4a6d24092ac7e0e2 |
| 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_1204 |
