CID 5486049
Morphinan, 17-(2-(p-anisyl)ethyl)-3-methoxy-, hydrochloride, (-)-
Structural Information
- Molecular Formula
- C26H33NO2
- SMILES
- COC1=CC=C(C=C1)CCN2CC[C@]34CCCC[C@H]3[C@H]2CC5=C4C=C(C=C5)OC
- InChI
- InChI=1S/C26H33NO2/c1-28-21-9-6-19(7-10-21)12-15-27-16-14-26-13-4-3-5-23(26)25(27)17-20-8-11-22(29-2)18-24(20)26/h6-11,18,23,25H,3-5,12-17H2,1-2H3/t23-,25+,26+/m0/s1
- InChIKey
- QETHAUXEBJJFJH-SKBVVQJISA-N
- Compound name
- (1R,9R,10R)-4-methoxy-17-[2-(4-methoxyphenyl)ethyl]-17-azatetracyclo[7.5.3.01,10.02,7]heptadeca-2(7),3,5-triene
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 392.25841 | 199.7 |
[M+Na]+ | 414.24035 | 202.7 |
[M-H]- | 390.24385 | 205.1 |
[M+NH4]+ | 409.28495 | 213.2 |
[M+K]+ | 430.21429 | 196.5 |
[M+H-H2O]+ | 374.24839 | 186.8 |
[M+HCOO]- | 436.24933 | 209.5 |
[M+CH3COO]- | 450.26498 | 206.3 |
[M+Na-2H]- | 412.22580 | 201.1 |
[M]+ | 391.25058 | 195.6 |
[M]- | 391.25168 | 195.6 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.