CID 29942769
2751603-58-2
Structural Information
- Molecular Formula
- C16H28N2O6
- SMILES
- CC(C)(C)OC(=O)N1CCN([C@H](C1)CC(=O)O)C(=O)OC(C)(C)C
- InChI
- InChI=1S/C16H28N2O6/c1-15(2,3)23-13(21)17-7-8-18(11(10-17)9-12(19)20)14(22)24-16(4,5)6/h11H,7-10H2,1-6H3,(H,19,20)/t11-/m0/s1
- InChIKey
- NOSKITKFSSMMRP-NSHDSACASA-N
- Compound name
- 2-[(2S)-1,4-bis[(2-methylpropan-2-yl)oxycarbonyl]piperazin-2-yl]acetic acid
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 345.20201 | 179.6 |
[M+Na]+ | 367.18395 | 183.4 |
[M-H]- | 343.18745 | 178.5 |
[M+NH4]+ | 362.22855 | 190.0 |
[M+K]+ | 383.15789 | 183.8 |
[M+H-H2O]+ | 327.19199 | 173.5 |
[M+HCOO]- | 389.19293 | 189.4 |
[M+CH3COO]- | 403.20858 | 208.2 |
[M+Na-2H]- | 365.16940 | 179.3 |
[M]+ | 344.19418 | 181.3 |
[M]- | 344.19528 | 181.3 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.