| SpectraBase Spectrum ID |
FMqglAeCa63 |
| Name |
Benzenesulfonic acid (2R,3R)-3-methyl-3-(4-methyl-pent-3-enyl)-oxiranylmethyl ester |
| 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(2)8-7-11-16(3)15(20-16)12-19-21(17,18)14-9-5-4-6-10-14/h4-6,8-10,15H,7,11-12H2,1-3H3/t15-,16-/m1/s1 |
| InChIKey |
ZSXYOXICXODZJW-HZPDHXFCSA-N |
| Molecular Weight |
310.408 g/mol |
| SMILES |
C(OS(=O)(=O)C1=CC=CC=C1)[C@]1(O[C@@]1(CCC=C(C)C)C)[H] |
