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Bumadizon
SpectraBase Compound ID F5EVPg2MrDN
InChI InChI=1S/C19H22N2O3/c1-2-3-14-17(19(23)24)18(22)21(16-12-8-5-9-13-16)20-15-10-6-4-7-11-15/h4-13,17,20H,2-3,14H2,1H3,(H,23,24)
InChIKey FLWFHHFTIRLFPV-UHFFFAOYSA-N
Mol Weight 326.4 g/mol
Molecular Formula C19H22N2O3
Exact Mass 326.163043 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8K9tjM9SBbk
Name Bumadizone
CAS Registry Number 3583-64-0
Classification Pharmaceutical drug, analgesic, antipyretic, anti-inflammatory
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 326.163042573 u
Formula C19H22N2O3
InChI InChI=1S/C19H22N2O3/c1-2-3-14-17(19(23)24)18(22)21(16-12-8-5-9-13-16)20-15-10-6-4-7-11-15/h4-13,17,20H,2-3,14H2,1H3,(H,23,24)
InChIKey FLWFHHFTIRLFPV-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 326.396 g/mol
Nominal Mass 326 u
Quality 996
Retention Index 2417
SMILES OC(C(C(N(NC=1C=CC=CC1)C1=CC=CC=C1)=O)CCCC)=O
SPLASH splash10-03di-1900000000-326a5600ea851ec8a612
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Bumadizon Bumadizonum 2-[Anilino(phenyl)carbamoyl]hexanoic acid
Technique GC/MS
Wiley ID DD2024_012908