For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
(2S,5R,Rs)-2-Hydroxymethyl-5-methyl-2-(p-tolylsulfinylmethyl)tetrahydropyran
SpectraBase Compound ID 8Lw7s4kyoOI
InChI InChI=1S/C15H22O3S/c1-12-3-5-14(6-4-12)19(17)11-15(10-16)8-7-13(2)9-18-15/h3-6,13,16H,7-11H2,1-2H3/t13-,15+,19?/m1/s1
InChIKey OPQJVCJPXYKFBF-DEYXKNCISA-N
Mol Weight 282.4 g/mol
Molecular Formula C15H22O3S
Exact Mass 282.128966 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID FFpuWRXWBlY
Name (2S,5R,Rs)-2-Hydroxymethyl-5-methyl-2-(p-tolylsulfinylmethyl)tetrahydropyran
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H22O3S
InChI InChI=1S/C15H22O3S/c1-12-3-5-14(6-4-12)19(17)11-15(10-16)8-7-13(2)9-18-15/h3-6,13,16H,7-11H2,1-2H3/t13-,15+,19?/m1/s1
InChIKey OPQJVCJPXYKFBF-DEYXKNCISA-N
Molecular Weight 282.398 g/mol
SMILES OC[C@@]1(C[S@](c2ccc(cc2)C)=O)OC[C@@](CC1)(C)[H]
SPLASH splash10-0006-0900000000-4de097f8fd90d8b91424
Source of Spectrum F-54-13099-10
Synonyms ((2S,5R)-5-methyl-2-{[(4-methylphenyl)sulfinyl]methyl}tetrahydro-2H-pyran-2-yl)methanol
Wiley ID 809427