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1-(Phenylsulfanylmethyl)cyclododecan-1-ol
SpectraBase Compound ID 2RucV0mSxm2
InChI InChI=1S/C19H30OS/c20-19(17-21-18-13-9-8-10-14-18)15-11-6-4-2-1-3-5-7-12-16-19/h8-10,13-14,20H,1-7,11-12,15-17H2
InChIKey LBBYZTJNFHNDDA-UHFFFAOYSA-N
Mol Weight 306.51 g/mol
Molecular Formula C19H30OS
Exact Mass 306.201737 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EdBLfnZNUuZ
Name 1-(Phenylsulfanylmethyl)cyclododecan-1-ol
Alternate Name(s) 1-[(phenylthio)methyl]-1-cyclododecanol 1-[(Phenylthio)methyl]cyclododecanol
CAS Registry Number 69036-34-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H30OS
InChI InChI=1S/C19H30OS/c20-19(17-21-18-13-9-8-10-14-18)15-11-6-4-2-1-3-5-7-12-16-19/h8-10,13-14,20H,1-7,11-12,15-17H2
InChIKey LBBYZTJNFHNDDA-UHFFFAOYSA-N
Molecular Weight 306.508 g/mol
SMILES OC1(CSc2ccccc2)CCCCCCCCCCC1
SPLASH splash10-00di-1900000000-6afcee1e00d37014ea23
Source of Spectrum KC-1989-307-17
Wiley ID 1308354