SpectraBase Spectrum ID |
59YrrBNSNp5 |
Name |
(6-ETHYLSULFANYL-3-OXO-2-OXABICYCLO[3.3.1]NON-7-YL)ACETIC ACID, METHYL ESTER |
Copyright |
Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
Formula |
C13H20O4S |
InChI |
InChI=1S/C13H20O4S/c1-3-18-13-8(6-11(14)16-2)4-10-5-9(13)7-12(15)17-10/h8-10,13H,3-7H2,1-2H3/t8?,9-,10+,13?/m0/s1 |
InChIKey |
HWPAHVRFZSJCRN-CABQIACGSA-N |
Molecular Weight |
272.1077 |
SMILES |
[C@]12(CC(CC(OC)=O)C(SCC)[C@](CC(=O)O2)(C1)[H])[H] |
SPLASH |
splash10-0uml-8910000000-e573d67c820f68135f1c |
Source of Spectrum |
Chemical Concepts, A Wiley Division, Weinheim, Germany |