| SpectraBase Spectrum ID |
9ugD1eCeS4B |
| Name |
D-arabino-Hexonic acid, 3-deoxy-5,6-O-(1-methylethylidene)-2-S-phenyl-2-thio-, .gamma.-lactone |
| CAS Registry Number |
128856-60-0 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C15H18O4S |
| InChI |
InChI=1S/C15H18O4S/c1-15(2)17-9-12(19-15)11-8-13(14(16)18-11)20-10-6-4-3-5-7-10/h3-7,11-13H,8-9H2,1-2H3/t11-,12+,13-/m0/s1 |
| InChIKey |
ZNTAUJHBGNYSIT-XQQFMLRXSA-N |
| Molecular Weight |
294.365 g/mol |
| SMILES |
C1(O[C@]([C@@]2(OC(C)(C)OC2)[H])(C[C@@]1(Sc1ccccc1)[H])[H])=O |
| SPLASH |
splash10-002f-0090000000-5d7013a63fc200965b2a |
| Source of Spectrum |
F-45-6641-20 |
| Synonyms |
(3S,5S)-5-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-3-(phenylsulfanyl)oxolan-2-one
cis and trans (4S,5R)-4-[5,6-O-(1-methylethylidene)]-2-thiophenylbutyrolactone |
| Wiley ID |
1296935 |
