| SpectraBase Spectrum ID |
56qstfOvK9D |
| Name |
1,3-Propanediol, monobenzoate |
| Alternate Name(s) |
3-Hydroxypropyl benzoate
1-O-benzoyl-1,3-propanediol
3-Oxidanylpropyl benzoate
benzoic acid 3-hydroxypropyl ester
AI3-06378 |
| 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(c1ccccc1)=O |
| SPLASH |
splash10-0a4i-9800000000-740530030231e6de484b |
| Source of Spectrum |
NW-971-0-0 |
| Wiley ID |
1176299 |
