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2-Butanone, 1-diazo-3-phenyl-4-(1H-pyrrol-1-yl)-, (.+-.)-

View entire compound with spectra: 1 MS (GC)

2-Butanone, 1-diazo-3-phenyl-4-(1H-pyrrol-1-yl)-, (.+-.)-
SpectraBase Compound ID 8TyTEnDlr5A
InChI InChI=1S/C14H13N3O/c15-16-10-14(18)13(11-17-8-4-5-9-17)12-6-2-1-3-7-12/h1-10,13H,11H2
InChIKey HGRHPFVSFIQUPG-UHFFFAOYSA-N
Mol Weight 239.28 g/mol
Molecular Formula C14H13N3O
Exact Mass 239.105862 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DSHHyuZRFzG
Name 2-Butanone, 1-diazo-3-phenyl-4-(1H-pyrrol-1-yl)-, (.+-.)-
Alternate Name(s) 1-Diazo-3-phenyl-4-(1H-pyrrol-1-yl)-2-butanone 1-Diazo-3-phenyl-4-(pyrrol-1''-yl)-2-butanone
CAS Registry Number 111751-84-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H13N3O
InChI InChI=1S/C14H13N3O/c15-16-10-14(18)13(11-17-8-4-5-9-17)12-6-2-1-3-7-12/h1-10,13H,11H2
InChIKey HGRHPFVSFIQUPG-UHFFFAOYSA-N
Molecular Weight 239.278 g/mol
SMILES C(=[N+]=[N-])C(C(C[n]1cccc1)c1ccccc1)=O
SPLASH splash10-0ke9-9600000000-583c7727cc07cf9041c7
Source of Spectrum H-69-2056-5
Wiley ID 1241980