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Mesaconic acid
SpectraBase Compound ID IK0OJZFAWne
InChI InChI=1S/C5H6O4/c1-3(5(8)9)2-4(6)7/h2H,1H3,(H,6,7)(H,8,9)/b3-2+
InChIKey HNEGQIOMVPPMNR-NSCUHMNNSA-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 EiHfpHX1CcD
Name 2-Butenedioic acid, 2-methyl-, (E)-
Alternate Name(s) (2E)-2-Methyl-2-butenedioic acid (2Z)-2-Methyl-2-butenedioic acid (E)-2-Methyl-2-butanedionic acid (E)-2-Methyl-2-butenedioic acid 2-Butenedioic acid, 2-methyl-, (Z)- (E)-2-methylbut-2-enedioic acid (Z)-2-Methyl-2-butenedioic acid 2-Butenedioic acid, 2-methyl-, (2E)- 2-Methyl-2-butenedioic acid 2-Methylfumarate 2-Methylfumaric acid 2-Methylmaleate Butenedioic acid, methyl-, (E)- cis-Methylbutenedioic acid Citraconate Citraconic acid Fumaric acid, methyl- Kyselina citrakonova Kyselina mesakonova Maleic acid, methyl- Mesaconate Mesaconic acid Methylfumaric acid Methylmaleic acid trans-1-Propene-1,2-dicarboxylic acid trans-2-Methyl-2-butenedioic acid BRN 1722679 BRN 1722680 EINECS 207-858-7 EINECS 207-859-2 NSC 32949 NSC 65438
CAS Registry Number 498-23-7
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Formula C5H6O4
InChI InChI=1S/C5H6O4/c1-3(5(8)9)2-4(6)7/h2H,1H3,(H,6,7)(H,8,9)/b3-2+
InChIKey HNEGQIOMVPPMNR-NSCUHMNNSA-N
Molecular Weight 130.099 g/mol
SMILES OC(\C=C\(C(=O)O)C)=O
SPLASH splash10-000l-9000000000-e2cf7de6ce81fdc90d68
Source of Spectrum O-2-549-3
Wiley ID 1132328