SpectraBase Spectrum ID |
H1KhTSKlbOa |
Name |
Rimonabant artifact (-CONH2) AC |
Classification |
Anorectic |
Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
421.015159801 u |
Formula |
C19H14N3O2Cl3 |
InChI |
InChI=1S/C19H14Cl3N3O2/c1-10-17(19(27)23-11(2)26)24-25(16-8-7-14(21)9-15(16)22)18(10)12-3-5-13(20)6-4-12/h3-9H,1-2H3,(H,23,26,27) |
InChIKey |
RJMGGKCXNBFSBS-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
422.699 g/mol |
SMILES |
c1c(ccc(c1)Cl)-c1c(c(n[n]1-c1c(cc(cc1)Cl)Cl)C(NC(C)=O)=O)C |
SPLASH |
splash10-01qj-2956100000-7437d0b0c7b0b991ae42 |
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. |
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_8303 |