CID 3054761
71746-33-3
Structural Information
- Molecular Formula
- C20H30N2O3
- SMILES
- CCCOC1=CC=CC=C1NC(=O)O[C@@H]2[C@H](C3CCC2CC3)N(C)C
- InChI
- InChI=1S/C20H30N2O3/c1-4-13-24-17-8-6-5-7-16(17)21-20(23)25-19-15-11-9-14(10-12-15)18(19)22(2)3/h5-8,14-15,18-19H,4,9-13H2,1-3H3,(H,21,23)/t14?,15?,18-,19-/m0/s1
- InChIKey
- HNYWXMISDLVDCD-BURPLHJFSA-N
- Compound name
- [(2S,3S)-3-(dimethylamino)-2-bicyclo[2.2.2]octanyl] N-(2-propoxyphenyl)carbamate
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 347.23293 | 181.5 |
[M+Na]+ | 369.21487 | 181.6 |
[M-H]- | 345.21837 | 181.2 |
[M+NH4]+ | 364.25947 | 198.8 |
[M+K]+ | 385.18881 | 180.3 |
[M+H-H2O]+ | 329.22291 | 174.0 |
[M+HCOO]- | 391.22385 | 193.1 |
[M+CH3COO]- | 405.23950 | 226.2 |
[M+Na-2H]- | 367.20032 | 187.6 |
[M]+ | 346.22510 | 184.9 |
[M]- | 346.22620 | 184.9 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.