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(3E)-4-(3-phenyl-1H-indol-2-yl)but-3-en-2-one
SpectraBase Compound ID 1kIF7aUAyoG
InChI InChI=1S/C18H15NO/c1-13(20)11-12-17-18(14-7-3-2-4-8-14)15-9-5-6-10-16(15)19-17/h2-12,19H,1H3/b12-11+
InChIKey JMYWZONUWUMIGP-VAWYXSNFSA-N
Mol Weight 261.32 g/mol
Molecular Formula C18H15NO
Exact Mass 261.115364 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1BAM5F05gda
Name (3E)-4-(3-phenyl-1H-indol-2-yl)but-3-en-2-one
Alternate Name(s) (E)-4-(3-phenyl-1H-indol-2-yl)but-3-en-2-one (E)-4-(3-phenyl-1H-indol-2-yl)-3-buten-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H15NO
InChI InChI=1S/C18H15NO/c1-13(20)11-12-17-18(14-7-3-2-4-8-14)15-9-5-6-10-16(15)19-17/h2-12,19H,1H3/b12-11+
InChIKey JMYWZONUWUMIGP-VAWYXSNFSA-N
Literature Reference DOI 10.1021/ol5018504
Molecular Weight 261.324 g/mol
SMILES [nH]1c(c(c2c1cccc2)-c1ccccc1)\C=C\C(C)=O
SPLASH splash10-02t9-1090000000-dc959f5fe2f5d9f7b198
Source of Spectrum A1-16-4150/SMS28-((E)_2f)
Wiley ID 1751062