SpectraBase Spectrum ID |
HVqVA5BWMTY |
Name |
1,3-Propanediol, monobenzoate |
CAS Registry Number |
6946-99-2 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C10H12O3 |
InChI |
InChI=1S/C10H12O3/c11-7-4-8-13-10(12)9-5-2-1-3-6-9/h1-3,5-6,11H,4,7-8H2 |
InChIKey |
BZISNWGGPWSXTK-UHFFFAOYSA-N |
Molecular Weight |
180.203 g/mol |
SMILES |
OCCCOC(=O)c1ccccc1 |
SPLASH |
splash10-0ab9-0900000000-db7fb2a5c3bcecff98d3 |
Source of Spectrum |
KC-1990-2829-20 |
Synonyms |
3-Hydroxypropyl benzoate
1-O-benzoyl-1,3-propanediol
3-Oxidanylpropyl benzoate
benzoic acid 3-hydroxypropyl ester
AI3-06378 |
Wiley ID |
1176251 |