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2-[hydroxy(phenyl)methyl]-2-propenoic acid tert-butyl ester
SpectraBase Compound ID IjXjUI9bmEp
InChI InChI=1S/C14H18O3/c1-10(13(16)17-14(2,3)4)12(15)11-8-6-5-7-9-11/h5-9,12,15H,1H2,2-4H3
InChIKey QDTMXXIXRPMTJI-UHFFFAOYSA-N
Mol Weight 234.29 g/mol
Molecular Formula C14H18O3
Exact Mass 234.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AHUsYqinx7h
Name 2-[hydroxy(phenyl)methyl]-2-propenoic acid tert-butyl ester
Alternate Name(s) 2-[hydroxy(phenyl)methyl]acrylic acid tert-butyl ester tert-butyl 2-[hydroxy(phenyl)methyl]prop-2-enoate tert-butyl 2-[oxidanyl(phenyl)methyl]prop-2-enoate
CAS Registry Number 135513-98-3
Comments Less than 3 mono-isotopic peaks
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Formula C14H18O3
InChI InChI=1S/C14H18O3/c1-10(13(16)17-14(2,3)4)12(15)11-8-6-5-7-9-11/h5-9,12,15H,1H2,2-4H3
InChIKey QDTMXXIXRPMTJI-UHFFFAOYSA-N
Molecular Weight 234.295 g/mol
SMILES OC(C(C(OC(C)(C)C)=O)=C)c1ccccc1
SPLASH splash10-004i-2900000000-aaeab0b507eeda6fb84e
Source of Spectrum K-124-2477-11
Wiley ID 1236168