CID 4177908
2-benzyl-9-phenyl-2,3-dihydro-1h-benzo[f]isoindol-1-one
Structural Information
- Molecular Formula
- C25H19NO
- SMILES
- C1C2=CC3=CC=CC=C3C(=C2C(=O)N1CC4=CC=CC=C4)C5=CC=CC=C5
- InChI
- InChI=1S/C25H19NO/c27-25-24-21(17-26(25)16-18-9-3-1-4-10-18)15-20-13-7-8-14-22(20)23(24)19-11-5-2-6-12-19/h1-15H,16-17H2
- InChIKey
- KCIFSGTXEPAHQS-UHFFFAOYSA-N
- Compound name
- 2-benzyl-4-phenyl-1H-benzo[f]isoindol-3-one
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 350.15395 | 185.7 |
[M+Na]+ | 372.13589 | 194.1 |
[M-H]- | 348.13939 | 195.7 |
[M+NH4]+ | 367.18049 | 200.5 |
[M+K]+ | 388.10983 | 185.8 |
[M+H-H2O]+ | 332.14393 | 175.1 |
[M+HCOO]- | 394.14487 | 205.1 |
[M+CH3COO]- | 408.16052 | 196.1 |
[M+Na-2H]- | 370.12134 | 188.6 |
[M]+ | 349.14612 | 184.9 |
[M]- | 349.14722 | 184.9 |
Literature stripe
Patent stripe
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