CID 50781
P-aminobenzoic acid (2-(isobutylamino)-2-methyl)propyl ester hydrochloride
Structural Information
- Molecular Formula
- C15H24N2O2
- SMILES
- CC(C)CNC(C)(C)COC(=O)C1=CC=C(C=C1)N
- InChI
- InChI=1S/C15H24N2O2/c1-11(2)9-17-15(3,4)10-19-14(18)12-5-7-13(16)8-6-12/h5-8,11,17H,9-10,16H2,1-4H3
- InChIKey
- CABOOJZDMBQWRB-UHFFFAOYSA-N
- Compound name
- [2-methyl-2-(2-methylpropylamino)propyl] 4-aminobenzoate
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 265.19106 | 165.4 |
[M+Na]+ | 287.17300 | 169.6 |
[M-H]- | 263.17650 | 168.0 |
[M+NH4]+ | 282.21760 | 181.2 |
[M+K]+ | 303.14694 | 167.8 |
[M+H-H2O]+ | 247.18104 | 158.6 |
[M+HCOO]- | 309.18198 | 186.4 |
[M+CH3COO]- | 323.19763 | 204.5 |
[M+Na-2H]- | 285.15845 | 167.5 |
[M]+ | 264.18323 | 165.6 |
[M]- | 264.18433 | 165.6 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.