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FNJSWIPFHMKRAT-UHFFFAOYSA-N
SpectraBase Compound ID m1XLVxqLUh
InChI InChI=1S/C9H8O4/c1-13-9(12)7-5-3-2-4-6(7)8(10)11/h2-5H,1H3,(H,10,11)
InChIKey FNJSWIPFHMKRAT-UHFFFAOYSA-N
Mol Weight 180.16 g/mol
Molecular Formula C9H8O4
Exact Mass 180.042259 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6s92DGroV9E
Name 1,2-Benzenedicarboxylic acid, monomethyl ester
Alternate Name(s) 2-(Methoxycarbonyl)benzoic acid 2-carbomethoxybenzoic acid Methyl hydrogen phthalate Methyl phthalate Monomethyl 1,2-benzenedicarboxylate Monomethyl phthalate o-(Methoxycarbonyl)benzoic acid Phthalic acid, methyl ester Phthalic acid, monomethyl ester D 3 (ester) AI3-02332 EINECS 224-476-6 NSC 8281
CAS Registry Number 4376-18-5
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Formula C9H8O4
InChI InChI=1S/C9H8O4/c1-13-9(12)7-5-3-2-4-6(7)8(10)11/h2-5H,1H3,(H,10,11)
InChIKey FNJSWIPFHMKRAT-UHFFFAOYSA-N
Molecular Weight 180.159 g/mol
SMILES OC(c1c(C(OC)=O)cccc1)=O
SPLASH splash10-0ufr-9700000000-13c8bae7af2280de5217
Source of Spectrum E-31-2078-18
Wiley ID 1175905