CID 191041
Um 747
Structural Information
- Molecular Formula
- C21H29NO
- SMILES
- CCC1C2CC3=C(C1(CCN2CC4CC4=C)CC)C=C(C=C3)O
- InChI
- InChI=1S/C21H29NO/c1-4-18-20-11-15-6-7-17(23)12-19(15)21(18,5-2)8-9-22(20)13-16-10-14(16)3/h6-7,12,16,18,20,23H,3-5,8-11,13H2,1-2H3
- InChIKey
- ARAVIORJOLQLBY-UHFFFAOYSA-N
- Compound name
- 1,13-diethyl-10-[(2-methylidenecyclopropyl)methyl]-10-azatricyclo[7.3.1.02,7]trideca-2(7),3,5-trien-4-ol
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 312.23218 | 181.0 |
[M+Na]+ | 334.21412 | 189.2 |
[M-H]- | 310.21762 | 184.8 |
[M+NH4]+ | 329.25872 | 193.9 |
[M+K]+ | 350.18806 | 182.5 |
[M+H-H2O]+ | 294.22216 | 173.2 |
[M+HCOO]- | 356.22310 | 192.2 |
[M+CH3COO]- | 370.23875 | 189.7 |
[M+Na-2H]- | 332.19957 | 182.7 |
[M]+ | 311.22435 | 181.2 |
[M]- | 311.22545 | 181.2 |
Literature stripe
Patent stripe
No patent data available for this compound.