CID 5486608
Gamma-isomorphine
Structural Information
- Molecular Formula
- C17H19NO3
- SMILES
- CN1CC[C@]23[C@@H]4C=C[C@@H]([C@H]2[C@H]1CC5=C3C(=C(C=C5)O)O4)O
- InChI
- InChI=1S/C17H19NO3/c1-18-7-6-17-13-5-4-11(19)15(17)10(18)8-9-2-3-12(20)16(21-13)14(9)17/h2-5,10-11,13,15,19-20H,6-8H2,1H3/t10-,11+,13+,15-,17-/m1/s1
- InChIKey
- NJMOXXXFTFWKLU-ZKRLBSCHSA-N
- Compound name
- (4R,4aR,5S,7aS,12bS)-3-methyl-2,4,4a,5,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinoline-5,9-diol
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 286.14378 | 164.6 |
[M+Na]+ | 308.12572 | 177.0 |
[M+NH4]+ | 303.17032 | 176.0 |
[M+K]+ | 324.09966 | 170.2 |
[M-H]- | 284.12922 | 167.8 |
[M+Na-2H]- | 306.11117 | 165.7 |
[M]+ | 285.13595 | 167.5 |
[M]- | 285.13705 | 167.5 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.