CID 57350121
478183-60-7
Structural Information
- Molecular Formula
- C12H21NO4
- SMILES
- CC(C)(C)OC(=O)N[C@@H](CC1CCC1)C(=O)O
- InChI
- InChI=1S/C12H21NO4/c1-12(2,3)17-11(16)13-9(10(14)15)7-8-5-4-6-8/h8-9H,4-7H2,1-3H3,(H,13,16)(H,14,15)/t9-/m0/s1
- InChIKey
- CXKVEJHPQAZLCY-VIFPVBQESA-N
- Compound name
- (2S)-3-cyclobutyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 244.15434 | 163.9 |
[M+Na]+ | 266.13628 | 164.9 |
[M+NH4]+ | 261.18088 | 164.5 |
[M+K]+ | 282.11022 | 164.7 |
[M-H]- | 242.13978 | 158.9 |
[M+Na-2H]- | 264.12173 | 161.5 |
[M]+ | 243.14651 | 160.8 |
[M]- | 243.14761 | 160.8 |
Literature stripe
No literature data available for this compound.