SpectraBase Spectrum ID |
GmWZjgx87Nd |
Name |
(Ss*,R*)-1-[2-(2,4,6-Triisopropylphenyl)sulfinyl]phenyl-3-buten-1-ol |
Comments |
Less than 3 mono-isotopic peaks |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C25H34O2S |
InChI |
InChI=1S/C25H34O2S/c1-5-11-19-17-20(12-6-2)25(21(18-19)13-7-3)28(27)24-16-10-9-15-22(24)23(26)14-8-4/h8-10,15-18,23,26H,4-7,11-14H2,1-3H3/t23-,28?/m1/s1 |
InChIKey |
WWSRVQSVRQBBFZ-YFIOFSHDSA-N |
Molecular Weight |
398.605 g/mol |
SMILES |
O[C@@](c1c([S@@](c2c(cc(cc2CCC)CCC)CCC)=O)cccc1)(CC=C)[H] |
SPLASH |
splash10-0006-0090000000-5383717523b8acf321ad |
Source of Spectrum |
KC-57-8478-11 |
Wiley ID |
1626022 |