| SpectraBase Spectrum ID |
8fvY5Afur9X |
| Name |
1-Hydroxy-5-phenylpentan-3-yl benzoate |
| Alternate Name(s) |
benzoic acid (1-hydroxy-5-phenylpentan-3-yl) ester
(1-hydroxy-5-phenylpentan-3-yl) benzoate
[1-(2-hydroxyethyl)-3-phenyl-propyl] benzoate
(1-oxidanyl-5-phenyl-pentan-3-yl) benzoate |
| Comments |
Note: The molecular formula of the structure shown is C18H20O3 - which differs from the formula reported for the mass spectrum (C18H18O3) |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H18O3 |
| InChI |
InChI=1S/C18H20O3/c19-14-13-17(12-11-15-7-3-1-4-8-15)21-18(20)16-9-5-2-6-10-16/h1-10,17,19H,11-14H2 |
| InChIKey |
ZLWBMQADTGQBGA-UHFFFAOYSA-N |
| Molecular Weight |
284.355 g/mol |
| SMILES |
OCCC(OC(c1ccccc1)=O)CCc1ccccc1 |
| SPLASH |
splash10-0bvl-6910000000-af2ae8bf42a6a634b32e |
| Source of Spectrum |
KC-0-334-27 |
| Wiley ID |
783133 |
