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Methyl 2-benzoyl-4-(pyrrol-1'-yl)butyrate
SpectraBase Compound ID 64thXN2NEAS
InChI InChI=1S/C16H17NO3/c1-20-16(19)14(9-12-17-10-5-6-11-17)15(18)13-7-3-2-4-8-13/h2-8,10-11,14H,9,12H2,1H3
InChIKey HZWQRDYBJYFZCQ-UHFFFAOYSA-N
Mol Weight 271.32 g/mol
Molecular Formula C16H17NO3
Exact Mass 271.120843 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F0V9j25BI10
Name Methyl 2-benzoyl-4-(pyrrol-1'-yl)butyrate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H17NO3
InChI InChI=1S/C16H17NO3/c1-20-16(19)14(9-12-17-10-5-6-11-17)15(18)13-7-3-2-4-8-13/h2-8,10-11,14H,9,12H2,1H3
InChIKey HZWQRDYBJYFZCQ-UHFFFAOYSA-N
Molecular Weight 271.316 g/mol
SMILES C(C(=O)c1ccccc1)(C(=O)OC)CC[n]1cccc1
SPLASH splash10-0536-9210000000-c5b98f66ac83f04be2c8
Source of Spectrum H-81-321-11
Synonyms Methyl 2-benzoyl-4-(1H-pyrrol-1-yl)butanoate
Wiley ID 1275358