CID 54671433
1333385-96-8
Structural Information
- Molecular Formula
- C33H37N2
- SMILES
- CC(C)(C)[C@@H](C1=CC=CC2=CC=CC=C21)N3C=C[N+](=C3)[C@H](C4=CC=CC5=CC=CC=C54)C(C)(C)C
- InChI
- InChI=1S/C33H37N2/c1-32(2,3)30(28-19-11-15-24-13-7-9-17-26(24)28)34-21-22-35(23-34)31(33(4,5)6)29-20-12-16-25-14-8-10-18-27(25)29/h7-23,30-31H,1-6H3/q+1/t30-,31-/m1/s1
- InChIKey
- USBWUGXWICGYQK-FIRIVFDPSA-N
- Compound name
- 1,3-bis[(1S)-2,2-dimethyl-1-naphthalen-1-ylpropyl]imidazol-1-ium
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 462.30298 | 226.4 |
[M+Na]+ | 484.28492 | 231.2 |
[M-H]- | 460.28842 | 234.8 |
[M+NH4]+ | 479.32952 | 234.8 |
[M+K]+ | 500.25886 | 218.0 |
[M+H-H2O]+ | 444.29296 | 217.3 |
[M+HCOO]- | 506.29390 | 238.0 |
[M+CH3COO]- | 520.30955 | 232.1 |
[M+Na-2H]- | 482.27037 | 229.8 |
[M]+ | 461.29515 | 226.7 |
[M]- | 461.29625 | 226.7 |
Literature stripe
Patent stripe
No patent data available for this compound.