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Benzoic acid, 2-[(3-diazo-4-ethoxy-2,4-dioxobutyl)thio]-, methyl ester
SpectraBase Compound ID EQYUaoodcqj
InChI InChI=1S/C14H14N2O5S/c1-3-21-14(19)12(16-15)10(17)8-22-11-7-5-4-6-9(11)13(18)20-2/h4-7H,3,8H2,1-2H3
InChIKey HVXLSWBNMVKEPL-UHFFFAOYSA-N
Mol Weight 322.34 g/mol
Molecular Formula C14H14N2O5S
Exact Mass 322.062343 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EiKq1HqXuFd
Name Benzoic acid, 2-[(3-diazo-4-ethoxy-2,4-dioxobutyl)thio]-, methyl ester
CAS Registry Number 131327-57-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H14N2O5S
InChI InChI=1S/C14H14N2O5S/c1-3-21-14(19)12(16-15)10(17)8-22-11-7-5-4-6-9(11)13(18)20-2/h4-7H,3,8H2,1-2H3
InChIKey HVXLSWBNMVKEPL-UHFFFAOYSA-N
Molecular Weight 322.335 g/mol
SMILES C(=[N+]=[N-])(C(CSc1c(C(=O)OC)cccc1)=O)C(=O)OCC
SPLASH splash10-00kk-6942000000-11a2035d785a7502171f
Source of Spectrum F-46-6537-9
Synonyms (Z)-2-diazonio-1-ethoxy-4-(2-methoxycarbonylphenyl)sulfanyl-3-oxidanylidene-but-1-en-1-olate (Z)-2-diazonio-1-ethoxy-4-(2-methoxycarbonylphenyl)sulfanyl-3-oxo-but-1-en-1-olate (Z)-2-diazonio-1-ethoxy-4-[(2-methoxycarbonylphenyl)thio]-3-oxo-1-buten-1-olate (Z)-4-[(2-carbomethoxyphenyl)thio]-2-diazonio-1-ethoxy-3-keto-but-1-en-1-olate Ethyl 2-diazo-4-[(2-methoxycarbonylphenyl)thio]-3-oxobutanoate Methyl 2-[(3-diazo-4-ethoxy-2,4-dioxobutyl)sulfanyl]benzoate (E)-3-diazonio-4-ethoxy-1-[(2-methoxycarbonylphenyl)thio]-4-oxo-2-buten-2-olate (E)-3-diazonio-4-ethoxy-1-(2-methoxycarbonylphenyl)sulfanyl-4-oxobut-2-en-2-olate (E)-3-diazonio-4-ethoxy-1-(2-methoxycarbonylphenyl)sulfanyl-4-oxo-but-2-en-2-olate (E)-3-diazonio-4-ethoxy-1-(2-methoxycarbonylphenyl)sulfanyl-4-oxidanylidene-but-2-en-2-olate
Wiley ID 1321373