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(S)-t-Butyl 5-hydroxy-1,3-cyclohexadien-1-carboxylate
SpectraBase Compound ID Gmbq2IG3dFa
InChI InChI=1S/C11H16O3/c1-11(2,3)14-10(13)8-5-4-6-9(12)7-8/h4-6,9,12H,7H2,1-3H3/t9-/m1/s1
InChIKey FWXCGPVQHGJNAV-SECBINFHSA-N
Mol Weight 196.25 g/mol
Molecular Formula C11H16O3
Exact Mass 196.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KMmYa3DoS6V
Name (S)-t-Butyl 5-hydroxy-1,3-cyclohexadien-1-carboxylate
Alternate Name(s) tert-Butyl (5S)-5-hydroxy-1,3-cyclohexadiene-1-carboxylate (5S)-5-hydroxy-1-cyclohexa-1,3-dienecarboxylic acid tert-butyl ester tert-Butyl (5S)-5-hydroxycyclohexa-1,3-diene-1-carboxylate tert-Butyl (5S)-5-oxidanylcyclohexa-1,3-diene-1-carboxylate
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Formula C11H16O3
InChI InChI=1S/C11H16O3/c1-11(2,3)14-10(13)8-5-4-6-9(12)7-8/h4-6,9,12H,7H2,1-3H3/t9-/m1/s1
InChIKey FWXCGPVQHGJNAV-SECBINFHSA-N
Molecular Weight 196.246 g/mol
SMILES O[C@@]1(C=CC=C(C(OC(C)(C)C)=O)C1)[H]
SPLASH splash10-0a4i-9800000000-154a0426c2a7094452ed
Source of Spectrum QC-8-1628-6
Wiley ID 869975