SpectraBase Spectrum ID |
KZ3sZNFaVtL |
Name |
[(1S)-2-(m-tolyl)cyclohex-2-en-1-yl] butanoate |
Appearance |
Viscous oil |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C17H22O2 |
InChI |
InChI=1S/C17H22O2/c1-3-7-17(18)19-16-11-5-4-10-15(16)14-9-6-8-13(2)12-14/h6,8-10,12,16H,3-5,7,11H2,1-2H3/t16-/m0/s1 |
InChIKey |
QRKUHLUXAFBSHY-INIZCTEOSA-N |
Instrument Name |
Hewlett-Packard 5971 |
Ionization Type |
EI |
Literature Reference DOI |
10.1021/acs.orglett.1c01375 |
Molecular Weight |
258.361 g/mol |
SMILES |
c1ccc(cc1C)C1=CCCC[C@@]1(OC(CCC)=O)[H] |
SPLASH |
splash10-05fr-0900000000-e85e4a08e413925529aa |
Source of Spectrum |
A1-23-SM9-5ea |
Wiley ID |
1867986 |