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O1-ethyl O4-prop-2-ynyl but-2-enedioate
SpectraBase Compound ID HVUBzCHVAHD
InChI InChI=1S/C9H10O4/c1-3-7-13-9(11)6-5-8(10)12-4-2/h1,5-6H,4,7H2,2H3/b6-5+
InChIKey BLAPCOUNYALUFN-AATRIKPKSA-N
Mol Weight 182.17 g/mol
Molecular Formula C9H10O4
Exact Mass 182.057909 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B2DxxrExvIO
Name O1-ethyl O4-prop-2-ynyl but-2-enedioate
Appearance Colorless liquid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H10O4
InChI InChI=1S/C9H10O4/c1-3-7-13-9(11)6-5-8(10)12-4-2/h1,5-6H,4,7H2,2H3/b6-5+
InChIKey BLAPCOUNYALUFN-AATRIKPKSA-N
Ionization Type EI
Molecular Weight 182.175 g/mol
SMILES C(OCC)(\C=C\C(OCC#C)=O)=O
SPLASH splash10-004i-9700000000-d9baa25a7779f5c25406
Source of Spectrum EP3119791B1
Thin-Layer Chromatography Rf = 0.5 (cyclohexane/ethyl acetate, 8:2)
Wiley ID 1872750