SpectraBase Spectrum ID |
5DNPwGT88u4 |
Name |
Spirohexane-1-carboxylic acid, 1-chloro-2-phenyl-, 1,1-dimethylethyl ester, trans- |
CAS Registry Number |
87957-58-2 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C17H21ClO2 |
InChI |
InChI=1S/C17H21ClO2/c1-15(2,3)20-14(19)17(18)13(16(17)10-7-11-16)12-8-5-4-6-9-12/h4-6,8-9,13H,7,10-11H2,1-3H3/t13-,17+/m1/s1 |
InChIKey |
XYHONUSLWSHULT-DYVFJYSZSA-N |
Molecular Weight |
292.806 g/mol |
SMILES |
[C@@]1(C2(CCC2)[C@]1(c1ccccc1)[H])(C(OC(C)(C)C)=O)Cl |
SPLASH |
splash10-0a4i-6090000000-d48ead37891ca9e9154e |
Source of Spectrum |
K-116-3105-0 |
Synonyms |
tert-Butyl (1R,2R)-1-chloro-2-phenylspiro[2.3]hexane-1-carboxylate
tert-Butylester of 1-chloro-c-2-phenyl-spiro[2.3]hexan-r-1-carboxylic acid |
Wiley ID |
1295515 |