| SpectraBase Spectrum ID |
LTHaCuiPVro |
| Name |
Benzoic acid, 3-(3-hydroxy-1-propynyl)-, ethyl ester |
| CAS Registry Number |
114837-79-5 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H12O3 |
| InChI |
InChI=1S/C12H12O3/c1-2-15-12(14)11-7-3-5-10(9-11)6-4-8-13/h3,5,7,9,13H,2,8H2,1H3 |
| InChIKey |
ZREQTSCTALYAFT-UHFFFAOYSA-N |
| Molecular Weight |
204.225 g/mol |
| SMILES |
OCC#Cc1cc(C(=O)OCC)ccc1 |
| SPLASH |
splash10-0kai-1910000000-2b519531ed022cd1b46e |
| Source of Spectrum |
J-53-3217-39 |
| Synonyms |
Ethyl 3-(3-hydroxy-1-propynyl)benzoate
Ethyl 3-(3-hydroxyprop-1-yn-1-yl)benzoate
Ethyl 3-(3-hydroxyprop-1-ynyl)benzoate
Ethyl 3-(3-oxidanylprop-1-ynyl)benzoate |
| Wiley ID |
1201826 |
