| SpectraBase Spectrum ID |
sNrBs5p1QM |
| Name |
Methyl (1S,3S)-3-methyl-2,2-bis(phenylthio)cyclopropanecarboxylate |
| Appearance |
Colorless liquid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H18O2S2 |
| InChI |
InChI=1S/C18H18O2S2/c1-13-16(17(19)20-2)18(13,21-14-9-5-3-6-10-14)22-15-11-7-4-8-12-15/h3-13,16H,1-2H3/t13-,16-/m0/s1 |
| InChIKey |
RZRXTFKCOMPBKF-BBRMVZONSA-N |
| Instrument Name |
Shimadzu GCMS QP2010 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.3998/ark.5550190.p008.380 |
| Molecular Weight |
330.460 g/mol |
| SMILES |
[C@@]1([C@@](C1(Sc1ccccc1)Sc1ccccc1)(C)[H])(C(=O)OC)[H] |
| SPLASH |
splash10-03di-0900000000-4c0aa8a707d4d9e56f71 |
| Sample Comments |
diastereomeric mixture (~1/1) |
| Source of Spectrum |
ARK-2014-84-(1S,3S)-4 |
| Wiley ID |
1845584 |
