| SpectraBase Spectrum ID |
6yuU7JKYMUP |
| Name |
Propanedioic acid, (1-phenyl-3-butynyl)-, monoethyl ester, (R*,R*)- |
| CAS Registry Number |
96666-64-7 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C15H16O4 |
| InChI |
InChI=1S/C15H16O4/c1-3-8-12(11-9-6-5-7-10-11)13(14(16)17)15(18)19-4-2/h1,5-7,9-10,12-13H,4,8H2,2H3,(H,16,17)/t12-,13+/m0/s1 |
| InChIKey |
JLKODFLAIPAXQH-QWHCGFSZSA-N |
| Molecular Weight |
260.289 g/mol |
| SMILES |
OC([C@](C(=O)OCC)([C@](c1ccccc1)(CC#C)[H])[H])=O |
| SPLASH |
splash10-0059-1900000000-94ccd59ebc23e681b1b2 |
| Source of Spectrum |
J-50-2334-7 |
| Synonyms |
(2R*,3R*)-2-ethoxycarbonyl-3-phenyl-5-hexynoic acid
(2R,3R)-2-(ethoxycarbonyl)-3-phenyl-5-hexynoic acid |
| Wiley ID |
1263803 |
