CID 45791246
1287753-35-8
Structural Information
- Molecular Formula
- C13H20BNO4
- SMILES
- B(C1=CC=C(C=C1)CN(C)C(=O)OC(C)(C)C)(O)O
- InChI
- InChI=1S/C13H20BNO4/c1-13(2,3)19-12(16)15(4)9-10-5-7-11(8-6-10)14(17)18/h5-8,17-18H,9H2,1-4H3
- InChIKey
- GHRFYNCASJLKQN-UHFFFAOYSA-N
- Compound name
- [4-[[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]methyl]phenyl]boronic acid
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 266.15581 | 161.0 |
[M+Na]+ | 288.13775 | 169.3 |
[M+NH4]+ | 283.18235 | 166.3 |
[M+K]+ | 304.11169 | 166.8 |
[M-H]- | 264.14125 | 160.3 |
[M+Na-2H]- | 286.12320 | 164.3 |
[M]+ | 265.14798 | 161.6 |
[M]- | 265.14908 | 161.6 |
Literature stripe
No literature data available for this compound.