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(2-Methoxycarbonylmethyl-3,5-dioxo-4-phenyl-[1,2,4]triazolidin-1-yl)-acetic acid methyl ester
SpectraBase Compound ID 1aETvRYbPtq
InChI InChI=1S/C14H15N3O6/c1-22-11(18)8-15-13(20)17(10-6-4-3-5-7-10)14(21)16(15)9-12(19)23-2/h3-7H,8-9H2,1-2H3
InChIKey VAQHKNZUGNJRIG-UHFFFAOYSA-N
Mol Weight 321.29 g/mol
Molecular Formula C14H15N3O6
Exact Mass 321.096085 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AMGg4giDuGq
Name (2-Methoxycarbonylmethyl-3,5-dioxo-4-phenyl-[1,2,4]triazolidin-1-yl)-acetic acid methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H15N3O6
InChI InChI=1S/C14H15N3O6/c1-22-11(18)8-15-13(20)17(10-6-4-3-5-7-10)14(21)16(15)9-12(19)23-2/h3-7H,8-9H2,1-2H3
InChIKey VAQHKNZUGNJRIG-UHFFFAOYSA-N
Molecular Weight 321.289 g/mol
SMILES c1ccc(N2C(N(CC(=O)OC)N(C2=O)CC(=O)OC)=O)cc1
SPLASH splash10-014i-9842000000-b984b02d0cc5f0c78675
Synonyms 2-[2-(2-methoxy-2-oxoethyl)-3,5-dioxo-4-phenyl-1,2,4-triazolidin-1-yl]acetic acid methyl ester 2-[3,5-diketo-2-(2-keto-2-methoxy-ethyl)-4-phenyl-1,2,4-triazolidin-1-yl]acetic acid methyl ester Methyl 2-[2-(2-methoxy-2-oxidanylidene-ethyl)-3,5-bis(oxidanylidene)-4-phenyl-1,2,4-triazolidin-1-yl]ethanoate Methyl 2-[2-(2-methoxy-2-oxo-ethyl)-3,5-dioxo-4-phenyl-1,2,4-triazolidin-1-yl]acetate
Wiley ID 1461102