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Methyl hydrogen isophthalate
SpectraBase Compound ID 545HvEp3Kr5
InChI InChI=1S/C9H8O4/c1-13-9(12)7-4-2-3-6(5-7)8(10)11/h2-5H,1H3,(H,10,11)
InChIKey WMZNGTSLFSJHMZ-UHFFFAOYSA-N
Mol Weight 180.16 g/mol
Molecular Formula C9H8O4
Exact Mass 180.042259 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BNwizEQLt0g
Name BENZOIC ACID, 3-(ACETYLOXY)-
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Formula C9H8O4
InChI InChI=1S/C9H8O4/c1-13-9(12)7-4-2-3-6(5-7)8(10)11/h2-5H,1H3,(H,10,11)
InChIKey WMZNGTSLFSJHMZ-UHFFFAOYSA-N
Instrument Name VARIAN XL-200
NMR Standard TMS
Solvent CDCL3