CID 16154
Unii-us46xlx8yh
Structural Information
- Molecular Formula
- C20H29NO3
- SMILES
- CCN1CCCC1COC(=O)C(C2CCCC2)(C3=CC=CC=C3)O
- InChI
- InChI=1S/C20H29NO3/c1-2-21-14-8-13-18(21)15-24-19(22)20(23,17-11-6-7-12-17)16-9-4-3-5-10-16/h3-5,9-10,17-18,23H,2,6-8,11-15H2,1H3
- InChIKey
- QQJCHGFBFHJEGB-UHFFFAOYSA-N
- Compound name
- (1-ethylpyrrolidin-2-yl)methyl 2-cyclopentyl-2-hydroxy-2-phenylacetate
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 332.22203 | 182.9 |
[M+Na]+ | 354.20397 | 184.4 |
[M-H]- | 330.20747 | 188.6 |
[M+NH4]+ | 349.24857 | 197.3 |
[M+K]+ | 370.17791 | 181.1 |
[M+H-H2O]+ | 314.21201 | 175.1 |
[M+HCOO]- | 376.21295 | 197.9 |
[M+CH3COO]- | 390.22860 | 204.3 |
[M+Na-2H]- | 352.18942 | 179.8 |
[M]+ | 331.21420 | 178.9 |
[M]- | 331.21530 | 178.9 |
Literature stripe
No literature data available for this compound.