| SpectraBase Spectrum ID |
645e2Ybc2s3 |
| Name |
10Ch-dibenzo[2,3:4,5]pentaleno[1,6-bc]furan, methanone deriv. |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
502.193280075 u |
| Formula |
C37H26O2 |
| InChI |
InChI=1S/C37H26O2/c1-24-20-22-27(23-21-24)37-31-19-11-10-18-30(31)32-28-16-8-9-17-29(28)33(34(39-37)25-12-4-2-5-13-25)36(32,37)35(38)26-14-6-3-7-15-26/h2-23,32H,1H3/t32?,36?,37-/m1/s1 |
| InChIKey |
CKQMJOKWVXONMT-YFMPQHEJSA-N |
| Molecular Weight |
502.613 g/mol |
| SMILES |
C12([C@@]3(OC(=C2C=2C=CC=CC2C1C=1C=CC=CC31)C=1C=CC=CC1)C=1C=CC(C)=CC1)C(=O)C=1C=CC=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.92004 |
![10Ch-dibenzo[2,3:4,5]pentaleno[1,6-bc]furan, methanone deriv.](/api/spectrum/645e2Ybc2s3/structure.png?h=300&w=458 "10Ch-dibenzo[2,3:4,5]pentaleno[1,6-bc]furan, methanone deriv.")
