| SpectraBase Spectrum ID |
9Nly3PMxw4 |
| Name |
1,3-[1'-(2''-Benzoyl-3''-phenyl)cyclopropylcarbonyl]benzene |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
574.214409442 u |
| Formula |
C40H30O4 |
| InChI |
InChI=1S/C40H30O4/c41-37(27-18-9-3-10-19-27)33-31(25-14-5-1-6-15-25)35(33)39(43)29-22-13-23-30(24-29)40(44)36-32(26-16-7-2-8-17-26)34(36)38(42)28-20-11-4-12-21-28/h1-24,31-36H |
| InChIKey |
BBBVLFPNNROCCO-UHFFFAOYSA-N |
| Molecular Weight |
574.676 g/mol |
| SMILES |
C1(C(C(=O)C=2C=CC=CC2)C1C=1C=CC=CC1)C(C1=CC(C(C2C(C(=O)C3=CC=CC=C3)C2C=2C=CC=CC2)=O)=CC=C1)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.913538 |
![1,3-[1'-(2''-Benzoyl-3''-phenyl)cyclopropylcarbonyl]benzene](/api/spectrum/9Nly3PMxw4/structure.png?h=300&w=458 "1,3-[1'-(2''-Benzoyl-3''-phenyl)cyclopropylcarbonyl]benzene")
