| SpectraBase Spectrum ID |
ACUeDNEGkAI |
| Name |
2-Phenylthiomethyl-3(S)-methoxycarbonyl-4(R)-pentyl-.gamma-butyrolactone |
| Alternate Name(s) |
Methyl (2R,3S)-5-oxo-2-pentyl-4-[(phenylsulfanyl)methyl]tetrahydro-3-furancarboxylate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H24O4S |
| InChI |
InChI=1S/C18H24O4S/c1-3-4-6-11-15-16(18(20)21-2)14(17(19)22-15)12-23-13-9-7-5-8-10-13/h5,7-10,14-16H,3-4,6,11-12H2,1-2H3/t14?,15-,16+/m1/s1 |
| InChIKey |
FLUDNLGKISBJEO-JAIYHHTPSA-N |
| Molecular Weight |
336.446 g/mol |
| SMILES |
C1([C@@]([C@@](CCCCC)(OC1=O)[H])(C(=O)OC)[H])CSc1ccccc1 |
| SPLASH |
splash10-0019-2903000000-54466c1eb8c7f8dbac0a |
| Source of Spectrum |
QC-6-891-9 |
| Wiley ID |
868820 |
