SpectraBase Spectrum ID |
Hm18EPveWxS |
Name |
Bicyclo[2.2.1]heptane-2-carboxylic acid, 3-[[(1-methylethyl)thio]methyl]-, methyl ester, [1S-(endo,endo)]- |
CAS Registry Number |
128208-17-3 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C13H22O2S |
InChI |
InChI=1S/C13H22O2S/c1-8(2)16-7-11-9-4-5-10(6-9)12(11)13(14)15-3/h8-12H,4-7H2,1-3H3/t9-,10+,11-,12+/m1/s1 |
InChIKey |
OCHVRQVXFUSEQY-KXNHARMFSA-N |
Molecular Weight |
242.377 g/mol |
SMILES |
[C@]1([C@@]2(C[C@]([C@]1(CSC(C)C)[H])(CC2)[H])[H])(C(=O)OC)[H] |
SPLASH |
splash10-00kf-8910000000-e5577b1c5433799d0c2a |
Source of Spectrum |
F-45-7314-4 |
Synonyms |
(2S,3R)-cis-endo-3-(2-propylthiomethyl)bicyclo[2.2.1]heptane-2-carboxylic acid methyl ester
Methyl (1R,2S,3R,4R)-3-[(isopropylsulfanyl)methyl]bicyclo[2.2.1]heptane-2-carboxylate |
Wiley ID |
1244917 |