SpectraBase Spectrum ID |
AlyoMRLoZxP |
Name |
4-Methyl-1,2-diphenyl-3,5-pyrazolidinedione |
CAS Registry Number |
42391-32-2 |
Classification |
Pharmaceutical drug artifact |
Comments |
Spectrum verified by independent measurements in external laboratories |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
266.105527697 u |
Formula |
C16H14N2O2 |
InChI |
InChI=1S/C16H14N2O2/c1-12-15(19)17(13-8-4-2-5-9-13)18(16(12)20)14-10-6-3-7-11-14/h2-12H,1H3 |
InChIKey |
AZKXYFOKOJPKLQ-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
266.300 g/mol |
Nominal Mass |
266 u |
Quality |
958 |
Retention Index |
2113 |
SMILES |
C=1(N2N(C(C(C2=O)C)=O)C=2C=CC=CC2)C=CC=CC1 |
SPLASH |
splash10-00lr-5940000000-992479c82434f9e9e192 |
Sample Comments |
Structure uncertain |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
4-methyl-1,2-diphenylpyrazolidine-3,5-dione |
Technique |
GC/MS |
Wiley ID |
DD2024_013299 |