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1-(Hydroxyphenylmethyl)cyclopropanecarbothioic acid, S-t-butyl ester
SpectraBase Compound ID EZX2ESEnrS8
InChI InChI=1S/C15H20O2S/c1-14(2,3)18-13(17)15(9-10-15)12(16)11-7-5-4-6-8-11/h4-8,12,16H,9-10H2,1-3H3
InChIKey XRIHBMLOMVKELR-UHFFFAOYSA-N
Mol Weight 264.38 g/mol
Molecular Formula C15H20O2S
Exact Mass 264.118401 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9qQ7x8202Um
Name 1-(Hydroxyphenylmethyl)cyclopropanecarbothioic acid, S-t-butyl ester
CAS Registry Number 58058-58-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H20O2S
InChI InChI=1S/C15H20O2S/c1-14(2,3)18-13(17)15(9-10-15)12(16)11-7-5-4-6-8-11/h4-8,12,16H,9-10H2,1-3H3
InChIKey XRIHBMLOMVKELR-UHFFFAOYSA-N
Molecular Weight 264.383 g/mol
SMILES OC(c1ccccc1)C1(C(=O)SC(C)(C)C)CC1
SPLASH splash10-056r-7900000000-1face225cb6f0e4d0f4d
Synonyms 1-[hydroxy(phenyl)methyl]-1-cyclopropanecarbothioic acid S-tert-butyl ester 1-[hydroxy(phenyl)methyl]cyclopropanecarbothioic acid S-tert-butyl ester S-tert-butyl 1-[hydroxy(phenyl)methyl]cyclopropane-1-carbothioate S-tert-butyl 1-[hydroxy(phenyl)methyl]cyclopropanecarbothioate S-tert-butyl 1-[oxidanyl(phenyl)methyl]cyclopropane-1-carbothioate
Wiley ID 1482553