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2-Butanone, 3-[4-(acetyloxy)phenyl]-1-diazo-4-(1H-pyrrol-1-yl)-, (.+-.)-
SpectraBase Compound ID BB9hkvZxchK
InChI InChI=1S/C16H15N3O3/c1-12(20)22-14-6-4-13(5-7-14)15(16(21)10-18-17)11-19-8-2-3-9-19/h2-10,15H,11H2,1H3
InChIKey NHXKHZUIADRTGY-UHFFFAOYSA-N
Mol Weight 297.31 g/mol
Molecular Formula C16H15N3O3
Exact Mass 297.111341 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3frW9FOOF7u
Name 2-Butanone, 3-[4-(acetyloxy)phenyl]-1-diazo-4-(1H-pyrrol-1-yl)-, (.+-.)-
CAS Registry Number 111751-83-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H15N3O3
InChI InChI=1S/C16H15N3O3/c1-12(20)22-14-6-4-13(5-7-14)15(16(21)10-18-17)11-19-8-2-3-9-19/h2-10,15H,11H2,1H3
InChIKey NHXKHZUIADRTGY-UHFFFAOYSA-N
Molecular Weight 297.314 g/mol
SMILES C(=[N+]=[N-])C(C(C[n]1cccc1)c1ccc(OC(=O)C)cc1)=O
SPLASH splash10-05gi-6900000000-a773c10158b882830aed
Source of Spectrum H-69-2055-5
Synonyms 3-(4'-Acetoxyphenyl)-1-diazo-4-(pyrrol-1''-yl)-2-butanone 4-[3-diazo-2-oxo-1-(1H-pyrrol-1-ylmethyl)propyl]phenyl acetate
Wiley ID 1300079