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1,4-Benzenedicarboxylic acid, mono(1-methylethyl) ester
SpectraBase Compound ID AECZfGSGBv8
InChI InChI=1S/C11H12O4/c1-7(2)15-11(14)9-5-3-8(4-6-9)10(12)13/h3-7H,1-2H3,(H,12,13)
InChIKey RIEGOSCYEGIECP-UHFFFAOYSA-N
Mol Weight 208.21 g/mol
Molecular Formula C11H12O4
Exact Mass 208.073559 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FMXnb5aUmUx
Name 1,4-Benzenedicarboxylic acid, mono(1-methylethyl) ester
Alternate Name(s) 4-(isopropoxycarbonyl)benzoic acid 4-[(propan-2-yloxy)carbonyl]benzoic acid 4-[oxo(propan-2-yloxy)methyl]benzoic acid 4-Propan-2-yloxycarbonylbenzoic acid
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Formula C11H12O4
InChI InChI=1S/C11H12O4/c1-7(2)15-11(14)9-5-3-8(4-6-9)10(12)13/h3-7H,1-2H3,(H,12,13)
InChIKey RIEGOSCYEGIECP-UHFFFAOYSA-N
Molecular Weight 208.213 g/mol
SMILES OC(c1ccc(C(OC(C)C)=O)cc1)=O
SPLASH splash10-0002-4900000000-40281c777bdfcb328c1e
Source of Spectrum JX-2015-5-912
Wiley ID 1727649