| SpectraBase Spectrum ID |
GdHWc5RA8Ro |
| Name |
3-(Pentacyclo[6.6.6.0(2,7).0(9,14).0(15,20)]icosa-2,4,6,9,11,13,15,17,19-nonaen-1-yl)propanoic acid |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
326.130679818 u |
| Formula |
C23H18O2 |
| InChI |
InChI=1S/C23H18O2/c24-21(25)13-14-23-18-10-4-1-7-15(18)22(16-8-2-5-11-19(16)23)17-9-3-6-12-20(17)23/h1-12,22H,13-14H2,(H,24,25) |
| InChIKey |
RUBYKDGHDGGDLO-UHFFFAOYSA-N |
| Molecular Weight |
326.395 g/mol |
| SMILES |
C12C3=C(C=CC=C3)C(C3=C1C=CC=C3)(C1=C2C=CC=C1)CCC(=O)O |
![3-(Pentacyclo[6.6.6.0(2,7).0(9,14).0(15,20)]icosa-2,4,6,9,11,13,15,17,19-nonaen-1-yl)propanoic acid](/api/spectrum/GdHWc5RA8Ro/structure.png?h=300&w=458 "3-(Pentacyclo[6.6.6.0(2,7).0(9,14).0(15,20)]icosa-2,4,6,9,11,13,15,17,19-nonaen-1-yl)propanoic acid")
