| SpectraBase Spectrum ID |
71Mn1iM1ZaI |
| Name |
(2S,4S,5R)-1-Chloro-5-(1',3'-dithian-2'-yl)-4,5-isopropylidenedioxy)pentan-2-ol |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H21ClO3S2 |
| InChI |
InChI=1S/C12H21ClO3S2/c1-12(2)15-9(6-8(14)7-13)10(16-12)11-17-4-3-5-18-11/h8-11,14H,3-7H2,1-2H3/t8-,9-,10+/m0/s1 |
| InChIKey |
XNDPLJDFIUUJDA-LPEHRKFASA-N |
| Molecular Weight |
312.870 g/mol |
| SMILES |
O[C@@](C[C@]1([C@@](OC(C)(C)O1)(C1SCCCS1)[H])[H])(CCl)[H] |
| SPLASH |
splash10-014i-0901000000-0735144175bbd915e437 |
| Source of Spectrum |
KC-1993-1513-31 |
| Wiley ID |
778166 |
