CID 3090501
2,2,4-trimethyl-6-trityl-1,2-dihydro-quinoline
Structural Information
- Molecular Formula
- C31H29N
- SMILES
- CC1=CC(NC2=C1C=C(C=C2)C(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5)(C)C
- InChI
- InChI=1S/C31H29N/c1-23-22-30(2,3)32-29-20-19-27(21-28(23)29)31(24-13-7-4-8-14-24,25-15-9-5-10-16-25)26-17-11-6-12-18-26/h4-22,32H,1-3H3
- InChIKey
- PTFCOZWCSXQOEY-UHFFFAOYSA-N
- Compound name
- 2,2,4-trimethyl-6-trityl-1H-quinoline
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 416.23728 | 209.3 |
[M+Na]+ | 438.21922 | 214.9 |
[M-H]- | 414.22272 | 218.8 |
[M+NH4]+ | 433.26382 | 219.1 |
[M+K]+ | 454.19316 | 205.4 |
[M+H-H2O]+ | 398.22726 | 196.2 |
[M+HCOO]- | 460.22820 | 223.5 |
[M+CH3COO]- | 474.24385 | 216.5 |
[M+Na-2H]- | 436.20467 | 213.3 |
[M]+ | 415.22945 | 204.9 |
[M]- | 415.23055 | 204.9 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.