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2-Butanone, 1-diazo-3-[4-(phenylmethoxy)phenyl]-4-(1H-pyrrol-1-yl)-, (.+-.)-
SpectraBase Compound ID LMDfDYNRJhH
InChI InChI=1S/C21H19N3O2/c22-23-14-21(25)20(15-24-12-4-5-13-24)18-8-10-19(11-9-18)26-16-17-6-2-1-3-7-17/h1-14,20H,15-16H2
InChIKey GXGMQAAZBXLQMF-UHFFFAOYSA-N
Mol Weight 345.4 g/mol
Molecular Formula C21H19N3O2
Exact Mass 345.147727 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KnIEV8ZDXMF
Name 2-Butanone, 1-diazo-3-[4-(phenylmethoxy)phenyl]-4-(1H-pyrrol-1-yl)-, (.+-.)-
CAS Registry Number 111778-22-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H19N3O2
InChI InChI=1S/C21H19N3O2/c22-23-14-21(25)20(15-24-12-4-5-13-24)18-8-10-19(11-9-18)26-16-17-6-2-1-3-7-17/h1-14,20H,15-16H2
InChIKey GXGMQAAZBXLQMF-UHFFFAOYSA-N
Molecular Weight 345.402 g/mol
SMILES C(=[N+]=[N-])C(C(C[n]1cccc1)c1ccc(OCc2ccccc2)cc1)=O
SPLASH splash10-0006-9000000000-e9a48192b72efb6e9e9f
Source of Spectrum H-69-2056-5
Synonyms 3-(4'-Benzyloxyphenyl)-1-diazo-4-(pyrrol-1''-yl)-2-butanone 3-[4-(benzyloxy)phenyl]-1-diazo-4-(1H-pyrrol-1-yl)-2-butanone
Wiley ID 1338755