SpectraBase Spectrum ID |
LQ0arQNFosW |
Name |
[(2R,3R)-2-Methyl-3-[(E)-3-methyl-5-(phenylsulfonyl)pent-3-enyl]oxiran-2-yl]methanol |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
310.123880358 u |
Formula |
C16H22O4S |
InChI |
InChI=1S/C16H22O4S/c1-13(8-9-15-16(2,12-17)20-15)10-11-21(18,19)14-6-4-3-5-7-14/h3-7,10,15,17H,8-9,11-12H2,1-2H3/b13-10+/t15-,16-/m1/s1 |
InChIKey |
JGLWTRSNRWLRAJ-ROCUKZSVSA-N |
Molecular Weight |
310.408 g/mol |
SMILES |
[C@]1(O[C@@]1(CC\C(=C\CS(=O)(=O)C=1C=CC=CC1)C)[H])(CO)C |