| SpectraBase Spectrum ID |
54NdUK9YRnQ |
| Name |
6-Benzo[b]pyrenecarboxylic acid hexyl ester |
| Alternate Name(s) |
benzo[b]pyrene-6-carboxylic acid hexyl ester
Hexyl benzo[b]pyrene-6-carboxylate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C27H24O2 |
| InChI |
InChI=1S/C27H24O2/c1-2-3-4-7-17-29-27(28)26-21-12-6-5-11-20(21)22-15-13-18-9-8-10-19-14-16-23(26)25(22)24(18)19/h5-6,8-16H,2-4,7,17H2,1H3 |
| InChIKey |
HRIMVYIJGNUWKA-UHFFFAOYSA-N |
| Molecular Weight |
380.487 g/mol |
| SMILES |
c12c(c(c3ccc4cccc5ccc2c3c45)C(=O)OCCCCCC)cccc1 |
| SPLASH |
splash10-001i-0059000000-ff91c62f33fddf4ddb41 |
| Source of Spectrum |
U1-2003-3164-5 |
| Wiley ID |
1523807 |
![6-Benzo[b]pyrenecarboxylic acid hexyl ester](/api/spectrum/54NdUK9YRnQ/structure.png?h=300&w=458 "6-Benzo[b]pyrenecarboxylic acid hexyl ester")
