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p-(3-hydroxy-3-methyl-1-butynyl)benzoic acid, methyl ester
SpectraBase Compound ID Ge5vYVh3ZQs
InChI InChI=1S/C13H14O3/c1-13(2,15)9-8-10-4-6-11(7-5-10)12(14)16-3/h4-7,15H,1-3H3
InChIKey HPQVSXSPVIQMCE-UHFFFAOYSA-N
Mol Weight 218.25 g/mol
Molecular Formula C13H14O3
Exact Mass 218.094294 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7OIxD4VRQ4m
Name p-(3-HYDROXY-3-METHYL-1-BUTYNYL)BENZOIC ACID, METHYL ESTER
Source of Sample S. J. Havens and P. M. Hergenrother, Nasa Langley Research Center, Hampton, Virginia
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H14O3
InChI InChI=1S/C13H14O3/c1-13(2,15)9-8-10-4-6-11(7-5-10)12(14)16-3/h4-7,15H,1-3H3
InChIKey HPQVSXSPVIQMCE-UHFFFAOYSA-N
Melting Point 83.5-84.5C
Molecular Weight 218.25
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20
Synonyms BENZOIC ACID, P-/3-HYDROXY- 3-METHYL-1-BUTYNYL/-, METHYL ESTER