CID 3021781
1h-pyrrole, 2-(4-cyclohexylphenyl)-1-(3,4-dichlorophenyl)-5-methyl-
Structural Information
- Molecular Formula
- C23H23Cl2N
- SMILES
- CC1=CC=C(N1C2=CC(=C(C=C2)Cl)Cl)C3=CC=C(C=C3)C4CCCCC4
- InChI
- InChI=1S/C23H23Cl2N/c1-16-7-14-23(26(16)20-12-13-21(24)22(25)15-20)19-10-8-18(9-11-19)17-5-3-2-4-6-17/h7-15,17H,2-6H2,1H3
- InChIKey
- TWLCMPLBCHZMHG-UHFFFAOYSA-N
- Compound name
- 2-(4-cyclohexylphenyl)-1-(3,4-dichlorophenyl)-5-methylpyrrole
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 384.12804 | 195.0 |
[M+Na]+ | 406.10998 | 202.9 |
[M-H]- | 382.11348 | 204.6 |
[M+NH4]+ | 401.15458 | 208.1 |
[M+K]+ | 422.08392 | 193.5 |
[M+H-H2O]+ | 366.11802 | 184.9 |
[M+HCOO]- | 428.11896 | 204.0 |
[M+CH3COO]- | 442.13461 | 204.1 |
[M+Na-2H]- | 404.09543 | 191.4 |
[M]+ | 383.12021 | 194.4 |
[M]- | 383.12131 | 194.4 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.