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2-Propenoic acid, 3-[3-(2-cyanoethenyl)-1-methyl-1H-indol-2-yl]-, methyl ester, (E,Z)-
SpectraBase Compound ID E2yNVtN0jRd
InChI InChI=1S/C16H14N2O2/c1-18-14-8-4-3-6-12(14)13(7-5-11-17)15(18)9-10-16(19)20-2/h3-10H,1-2H3/b7-5-,10-9+
InChIKey HFMCCJHHRHYWGE-ROBNAOGRSA-N
Mol Weight 266.3 g/mol
Molecular Formula C16H14N2O2
Exact Mass 266.105528 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GgK7uaq30kb
Name 2-Propenoic acid, 3-[3-(2-cyanoethenyl)-1-methyl-1H-indol-2-yl]-, methyl ester, (E,Z)-
Alternate Name(s) Methyl (2E)-3-{3-[(Z)-2-cyanoethenyl]-1-methyl-1H-indol-2-yl}-2-propenoate Methyl (E,Z)-3-[3-(2-cyanoethenyl)-1-methyl-1H-indol-2-yl]prop-2-enoate
CAS Registry Number 129866-30-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H14N2O2
InChI InChI=1S/C16H14N2O2/c1-18-14-8-4-3-6-12(14)13(7-5-11-17)15(18)9-10-16(19)20-2/h3-10H,1-2H3/b7-5-,10-9+
InChIKey HFMCCJHHRHYWGE-ROBNAOGRSA-N
Molecular Weight 266.300 g/mol
SMILES c1([n](c2ccccc2c1\C=C/C#N)C)\C=C\C(=O)OC
SPLASH splash10-0a4j-0490000000-5f9fd60749b10804fe5c
Source of Spectrum H-73-834-2
Wiley ID 1270259