| SpectraBase Spectrum ID |
Ch3MghMxqUV |
| Name |
3-Benzylisocoumarin |
| Alternate Name(s) |
3-Benzylisochromen-1-one
3-(Phenylmethyl)-2-benzopyran-1-one
3-(Phenylmethyl)isochromen-1-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H12O2 |
| InChI |
InChI=1S/C16H12O2/c17-16-15-9-5-4-8-13(15)11-14(18-16)10-12-6-2-1-3-7-12/h1-9,11H,10H2 |
| InChIKey |
ZNYDNBPXQLEEFV-UHFFFAOYSA-N |
| Molecular Weight |
236.270 g/mol |
| SMILES |
C1(=O)OC(=Cc2ccccc12)Cc1ccccc1 |
| SPLASH |
splash10-052r-0090000000-788af03d3d79a0c9fd4a |
| Source of Spectrum |
Y1-37-1022-2 |
| Wiley ID |
1527569 |
