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Methyl .beta.-Hydroxy-.alpha.-cyano-p-nitrocinnamate
SpectraBase Compound ID FLKDxbeNDnx
InChI InChI=1S/C11H8N2O5/c1-18-11(15)9(6-12)10(14)7-2-4-8(5-3-7)13(16)17/h2-5,14H,1H3/b10-9-
InChIKey OFJAFONOEMWDTJ-KTKRTIGZSA-N
Mol Weight 248.19 g/mol
Molecular Formula C11H8N2O5
Exact Mass 248.043321 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8Pu9zMLSFzd
Name Methyl .beta.-Hydroxy-.alpha.-cyano-p-nitrocinnamate
CAS Registry Number 80641-24-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H8N2O5
InChI InChI=1S/C11H8N2O5/c1-18-11(15)9(6-12)10(14)7-2-4-8(5-3-7)13(16)17/h2-5,14H,1H3/b10-9-
InChIKey OFJAFONOEMWDTJ-KTKRTIGZSA-N
Molecular Weight 248.194 g/mol
SMILES O\C(=C/(C(=O)OC)C#N)c1ccc(N(=O)=O)cc1
SPLASH splash10-0udi-0940000000-0b0c2e20f7df3607bd61
Source of Spectrum J-47-1407-0
Synonyms Methyl (2Z)-2-cyano-3-hydroxy-3-(4-nitrophenyl)-2-propenoate (Z)-2-cyano-3-hydroxy-3-(4-nitrophenyl)-2-propenoic acid methyl ester Methyl (Z)-2-cyano-3-hydroxy-3-(4-nitrophenyl)prop-2-enoate Methyl (Z)-2-cyano-3-(4-nitrophenyl)-3-oxidanyl-prop-2-enoate
Wiley ID 1250579