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Cyclobutanethiol, 4-ethoxy-2,2-dimethyl-1-phenyl-, cis-
SpectraBase Compound ID Dr6Y4R5hmEa
InChI InChI=1S/C14H20OS/c1-4-15-12-10-13(2,3)14(12,16)11-8-6-5-7-9-11/h5-9,12,16H,4,10H2,1-3H3/t12-,14-/m1/s1
InChIKey APLBPBJAPNOLCS-TZMCWYRMSA-N
Mol Weight 236.37 g/mol
Molecular Formula C14H20OS
Exact Mass 236.123486 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FG2NXqF08dU
Name Cyclobutanethiol, 4-ethoxy-2,2-dimethyl-1-phenyl-, cis-
Alternate Name(s) (1R,4R)-4-ethoxy-2,2-dimethyl-1-phenylcyclobutanethiol (1R,4R)-4-ethoxy-2,2-dimethyl-1-phenylcyclobutyl hydrosulfide 1-Phenyl-2-ethoxy-,4-dimethylcyclobutanethiol (isomer b)
CAS Registry Number 77787-35-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H20OS
InChI InChI=1S/C14H20OS/c1-4-15-12-10-13(2,3)14(12,16)11-8-6-5-7-9-11/h5-9,12,16H,4,10H2,1-3H3/t12-,14-/m1/s1
InChIKey APLBPBJAPNOLCS-TZMCWYRMSA-N
Molecular Weight 236.373 g/mol
SMILES S[C@]1(C(C[C@]1(OCC)[H])(C)C)c1ccccc1
SPLASH splash10-0udi-0190000000-ed13c7acc51ab5c840fb
Source of Spectrum I-59-253-0
Wiley ID 1238285