SpectraBase Spectrum ID |
L9QhVyshQIZ |
Name |
Butanoic acid, 3-[[1-(2-phenylethyl)-2-propynyl]oxy]-, [R-(R*,R*)]- |
CAS Registry Number |
99902-30-4 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C15H18O3 |
InChI |
InChI=1S/C15H18O3/c1-3-14(18-12(2)11-15(16)17)10-9-13-7-5-4-6-8-13/h1,4-8,12,14H,9-11H2,2H3,(H,16,17)/t12-,14+/m1/s1 |
InChIKey |
ZWMVARATRXIUTP-OCCSQVGLSA-N |
Molecular Weight |
246.306 g/mol |
SMILES |
OC(C[C@](O[C@@](C#C)(CCc1ccccc1)[H])(C)[H])=O |
SPLASH |
splash10-0006-6900000000-ed7286dc3e50cbb89dc2 |
Source of Spectrum |
H-70-461-26 |
Synonyms |
(3R)-3-{[(1R)-1-(2-phenylethyl)-2-propynyl]oxy}butanoic acid
(3R,5R)-3-methyl-5-(2'phenylethyl)-4-oxahept-6-insaure |
Wiley ID |
1249202 |