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

*Links on SpectraBase are not permalinks.
(1R,2S)-2-[(R)-.alpha.-Methoxy-.alpha.-(trifluoromethyl)phenylacetoxy]cyclopentyl (Rs)-(p-tolylsulfinyl)acetate
SpectraBase Compound ID 3wwytKCaFex
InChI InChI=1S/C24H25F3O6S/c1-16-11-13-18(14-12-16)34(30)15-21(28)32-19-9-6-10-20(19)33-22(29)23(31-2,24(25,26)27)17-7-4-3-5-8-17/h3-5,7-8,11-14,19-20H,6,9-10,15H2,1-2H3/t19-,20+,23+,34?/m0/s1
InChIKey CMJYWIFFGOMUTF-XRWKNRGYSA-N
Mol Weight 498.51 g/mol
Molecular Formula C24H25F3O6S
Exact Mass 498.132394 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 E2EHxUwfEQT
Name (1R,2S)-2-[(R)-.alpha.-Methoxy-.alpha.-(trifluoromethyl)phenylacetoxy]cyclopentyl (Rs)-(p-tolylsulfinyl)acetate
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H25F3O6S
InChI InChI=1S/C24H25F3O6S/c1-16-11-13-18(14-12-16)34(30)15-21(28)32-19-9-6-10-20(19)33-22(29)23(31-2,24(25,26)27)17-7-4-3-5-8-17/h3-5,7-8,11-14,19-20H,6,9-10,15H2,1-2H3/t19-,20+,23+,34?/m0/s1
InChIKey CMJYWIFFGOMUTF-XRWKNRGYSA-N
Molecular Weight 498.513 g/mol
SMILES [C@@](C(O[C@]1([C@@](OC(CS(c2ccc(cc2)C)=O)=O)(CCC1)[H])[H])=O)(C(F)(F)F)(c1ccccc1)OC
SPLASH splash10-000i-0900000000-14931ce2538466830418
Source of Spectrum F-52-6539-16
Synonyms (1R,2S)-2-({2-[(4-methylphenyl)sulfinyl]acetyl}oxy)cyclopentyl (2R)-3,3,3-trifluoro-2-methoxy-2-phenylpropanoate
Wiley ID 796590