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Itaconic acid
SpectraBase Compound ID IgyZTrCTyAa
InChI InChI=1S/C5H6O4/c1-3(5(8)9)2-4(6)7/h1-2H2,(H,6,7)(H,8,9)
InChIKey LVHBHZANLOWSRM-UHFFFAOYSA-N
Mol Weight 130.1 g/mol
Molecular Formula C5H6O4
Exact Mass 130.026609 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Dk5TDEPkuFs
Name BUTANEDIOIC ACID, METHYLENE-
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C5H6O4
InChI InChI=1S/C5H6O4/c1-3(5(8)9)2-4(6)7/h1-2H2,(H,6,7)(H,8,9)
InChIKey LVHBHZANLOWSRM-UHFFFAOYSA-N
Instrument Name 311A
Molecular Weight 130.0264
SMILES OC(C(CC(O)=O)=C)=O
SPLASH splash10-000l-9100000000-90dae0177de2a503fdc5
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany