| SpectraBase Spectrum ID |
CNPHj5LEPWF |
| Name |
Benzenecarbothioic acid, S-(hexahydro-1-hydroxy-1H-pyrrolizin-2-yl) ester, (1.alpha.,2.beta.,7a.beta.)-(.+-.)- |
| Alternate Name(s) |
1.beta.-hydroxy-2.alpha.-thiobenzylpyrrolizidine
S-[(1S,2S,7aR)-1-hydroxyhexahydro-1H-pyrrolo[1,2-a]pyrrol-2-yl]benzenecarbothioate |
| CAS Registry Number |
78719-91-2 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C14H17NO2S |
| InChI |
InChI=1S/C14H17NO2S/c16-13-11-7-4-8-15(11)9-12(13)18-14(17)10-5-2-1-3-6-10/h1-3,5-6,11-13,16H,4,7-9H2/t11-,12+,13+/m1/s1 |
| InChIKey |
FDJGMFNZRBWEDC-AGIUHOORSA-N |
| Molecular Weight |
263.355 g/mol |
| SMILES |
O[C@@]1([C@@](SC(=O)c2ccccc2)(CN2CCC[C@]12[H])[H])[H] |
| SPLASH |
splash10-004i-4900000000-b72a3821aa214098a2a3 |
| Source of Spectrum |
I-59-1104-0 |
| Wiley ID |
1266815 |
