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2-[hydroxy-(3-nitrophenyl)methyl]-2-propenoic acid ethyl ester
SpectraBase Compound ID 9NjyxKfmlaO
InChI InChI=1S/C12H13NO5/c1-3-18-12(15)8(2)11(14)9-5-4-6-10(7-9)13(16)17/h4-7,11,14H,2-3H2,1H3
InChIKey LYWCTQNSDPYAEM-UHFFFAOYSA-N
Mol Weight 251.24 g/mol
Molecular Formula C12H13NO5
Exact Mass 251.079373 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L4pwTNWjGwD
Name 2-[hydroxy-(3-nitrophenyl)methyl]-2-propenoic acid ethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H13NO5
InChI InChI=1S/C12H13NO5/c1-3-18-12(15)8(2)11(14)9-5-4-6-10(7-9)13(16)17/h4-7,11,14H,2-3H2,1H3
InChIKey LYWCTQNSDPYAEM-UHFFFAOYSA-N
Molecular Weight 251.238 g/mol
SMILES OC(C(C(=O)OCC)=C)c1cc(ccc1)N(=O)=O
SPLASH splash10-001i-0490000000-d5a0298c8e137d292a03
Source of Spectrum KC-61-1436-2
Synonyms 2-[hydroxy-(3-nitrophenyl)methyl]acrylic acid ethyl ester Ethyl 2-[(3-nitrophenyl)-oxidanyl-methyl]prop-2-enoate Ethyl 2-[hydroxy-(3-nitrophenyl)methyl]prop-2-enoate
Wiley ID 1627564