SpectraBase Spectrum ID |
FlPLonIDOCw |
Name |
4-(6-Benzo[B]pyrenyl)butanoic acid |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
338.130679818 u |
Formula |
C24H18O2 |
InChI |
InChI=1S/C24H18O2/c25-22(26)10-4-9-19-17-7-1-2-8-18(17)20-13-11-15-5-3-6-16-12-14-21(19)24(20)23(15)16/h1-3,5-8,11-14H,4,9-10H2,(H,25,26) |
InChIKey |
UWGWZPYBVFTADP-UHFFFAOYSA-N |
Molecular Weight |
338.406 g/mol |
SMILES |
C=12C3=C(CCCC(=O)O)C=4C(C2=CC=C2C1C(C=C3)=CC=C2)=CC=CC4 |