SpectraBase Spectrum ID |
3IYS11WBvM |
Name |
Ditazol-M (bis-dealkyl-HO-) 2AC |
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 |
336.111006999 u |
Formula |
C19H16N2O4 |
InChI |
InChI=1S/C19H16N2O4/c1-12(22)20-19-21-17(14-6-4-3-5-7-14)18(25-19)15-8-10-16(11-9-15)24-13(2)23/h3-11H,1-2H3,(H,20,21,22) |
InChIKey |
OYLQSUKMOMYJBJ-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
336.347 g/mol |
SMILES |
c1c(-c2c(nc(o2)NC(C)=O)-c2ccccc2)ccc(OC(C)=O)c1 |
SPLASH |
splash10-0udi-1791000000-903387d5f314334cf3d7 |
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_1202 |