CID 6435005
Brn 1504669
Structural Information
- Molecular Formula
- C23H25NO3
- SMILES
- CN1C2CCC1CC(C2)OC(=O)/C(=C/C3=CC=CC=C3)/C4=CC=C(C=C4)O
- InChI
- InChI=1S/C23H25NO3/c1-24-18-9-10-19(24)15-21(14-18)27-23(26)22(13-16-5-3-2-4-6-16)17-7-11-20(25)12-8-17/h2-8,11-13,18-19,21,25H,9-10,14-15H2,1H3/b22-13+
- InChIKey
- XXPMCYXTMLXWIG-LPYMAVHISA-N
- Compound name
- (8-methyl-8-azabicyclo[3.2.1]octan-3-yl) (E)-2-(4-hydroxyphenyl)-3-phenylprop-2-enoate
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 364.19072 | 188.9 |
[M+Na]+ | 386.17266 | 192.2 |
[M-H]- | 362.17616 | 194.2 |
[M+NH4]+ | 381.21726 | 201.8 |
[M+K]+ | 402.14660 | 186.6 |
[M+H-H2O]+ | 346.18070 | 179.9 |
[M+HCOO]- | 408.18164 | 202.1 |
[M+CH3COO]- | 422.19729 | 196.8 |
[M+Na-2H]- | 384.15811 | 186.9 |
[M]+ | 363.18289 | 185.3 |
[M]- | 363.18399 | 185.3 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.