SpectraBase Spectrum ID |
CxJLdlDbFTt |
Name |
2,2-Dimethyl-5-phenylpent-4-ynoic acid-1-(4-chlorophenyl)ethyl ester |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C21H21ClO2 |
InChI |
InChI=1S/C21H21ClO2/c1-16(18-11-13-19(22)14-12-18)24-20(23)21(2,3)15-7-10-17-8-5-4-6-9-17/h4-6,8-9,11-14,16H,15H2,1-3H3 |
InChIKey |
PJJRIJNBUMHIKM-UHFFFAOYSA-N |
Literature Reference DOI |
10.1021/ol8019567 |
Molecular Weight |
340.850 g/mol |
SMILES |
C(C(OC(c1ccc(cc1)Cl)C)=O)(C)(CC#Cc1ccccc1)C |
SPLASH |
splash10-0f79-0900000000-853da160b5496f3315dc |
Source of Spectrum |
A1-10-5119/SMS3-1c |
Synonyms |
1-(4-Chlorophenyl)ethyl 2,2-dimethyl-5-phenylpent-4-ynoate |
Wiley ID |
1759981 |