CID 3053119
69552-05-2
Structural Information
- Molecular Formula
- C16H23NO3
- SMILES
- CCC(=O)OC1(CCN(C1C)C)C2=CC(=CC=C2)OC
- InChI
- InChI=1S/C16H23NO3/c1-5-15(18)20-16(9-10-17(3)12(16)2)13-7-6-8-14(11-13)19-4/h6-8,11-12H,5,9-10H2,1-4H3
- InChIKey
- MSOHVPSPIRBWAL-UHFFFAOYSA-N
- Compound name
- [3-(3-methoxyphenyl)-1,2-dimethylpyrrolidin-3-yl] propanoate
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 278.17508 | 164.5 |
[M+Na]+ | 300.15702 | 171.7 |
[M-H]- | 276.16052 | 169.9 |
[M+NH4]+ | 295.20162 | 183.3 |
[M+K]+ | 316.13096 | 169.7 |
[M+H-H2O]+ | 260.16506 | 157.7 |
[M+HCOO]- | 322.16600 | 184.7 |
[M+CH3COO]- | 336.18165 | 199.6 |
[M+Na-2H]- | 298.14247 | 165.2 |
[M]+ | 277.16725 | 167.2 |
[M]- | 277.16835 | 167.2 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.