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3-carbethoxy-2-methyl-6-[(E)-styryl]isonicotinic acid
SpectraBase Compound ID 2wmfB2Y2MHF
InChI InChI=1S/C18H17NO4/c1-3-23-18(22)16-12(2)19-14(11-15(16)17(20)21)10-9-13-7-5-4-6-8-13/h4-11H,3H2,1-2H3,(H,20,21)/b10-9+
InChIKey NCYJAVTVRGCWFC-MDZDMXLPSA-N
Mol Weight 311.34 g/mol
Molecular Formula C18H17NO4
Exact Mass 311.115758 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID etzMzHrKC
Name 3-carbethoxy-2-methyl-6-[(E)-styryl]isonicotinic acid
Alternate Name(s) 3-Ethoxycarbonyl-2-methyl-6-[(E)-2-phenylethenyl]-4-pyridinecarboxylic acid 3-Ethoxycarbonyl-2-methyl-6-[(E)-2-phenylethenyl]pyridine-4-carboxylic acid 3-Ethoxycarbonyl-2-methyl-6-[(E)-styryl]pyridine-4-carboxylic acid
CAS Registry Number 58510-18-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H17NO4
InChI InChI=1S/C18H17NO4/c1-3-23-18(22)16-12(2)19-14(11-15(16)17(20)21)10-9-13-7-5-4-6-8-13/h4-11H,3H2,1-2H3,(H,20,21)/b10-9+
InChIKey NCYJAVTVRGCWFC-MDZDMXLPSA-N
Molecular Weight 311.337 g/mol
SMILES OC(c1c(c(nc(\C=C\c2ccccc2)c1)C)C(=O)OCC)=O
SPLASH splash10-03xu-0592000000-b2aaf62ac7b990ee34a0
Source of Spectrum Y-12-1300-0
Wiley ID 1312466