CID 15429161
163210-97-7
Structural Information
- Molecular Formula
- C12H16N2O2
- SMILES
- COC(=O)C1=CC=C(C=C1)N2CCNCC2
- InChI
- InChI=1S/C12H16N2O2/c1-16-12(15)10-2-4-11(5-3-10)14-8-6-13-7-9-14/h2-5,13H,6-9H2,1H3
- InChIKey
- BFFGYMOQOGMTBM-UHFFFAOYSA-N
- Compound name
- methyl 4-piperazin-1-ylbenzoate
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 221.12847 | 150.6 |
[M+Na]+ | 243.11041 | 155.4 |
[M-H]- | 219.11391 | 152.3 |
[M+NH4]+ | 238.15501 | 165.0 |
[M+K]+ | 259.08435 | 152.4 |
[M+H-H2O]+ | 203.11845 | 142.0 |
[M+HCOO]- | 265.11939 | 166.8 |
[M+CH3COO]- | 279.13504 | 184.4 |
[M+Na-2H]- | 241.09586 | 154.4 |
[M]+ | 220.12064 | 145.6 |
[M]- | 220.12174 | 145.6 |
Literature stripe
No literature data available for this compound.