CID 43117821
5-amino-5-(4-bromophenyl)pentanoic acid hydrochloride
Structural Information
- Molecular Formula
- C11H14BrNO2
- SMILES
- C1=CC(=CC=C1C(CCCC(=O)O)N)Br
- InChI
- InChI=1S/C11H14BrNO2/c12-9-6-4-8(5-7-9)10(13)2-1-3-11(14)15/h4-7,10H,1-3,13H2,(H,14,15)
- InChIKey
- BWMXQJCDAUPEQL-UHFFFAOYSA-N
- Compound name
- 5-amino-5-(4-bromophenyl)pentanoic acid
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 272.02806 | 155.1 |
[M+Na]+ | 294.01000 | 163.7 |
[M-H]- | 270.01350 | 159.0 |
[M+NH4]+ | 289.05460 | 173.5 |
[M+K]+ | 309.98394 | 151.9 |
[M+H-H2O]+ | 254.01804 | 153.9 |
[M+HCOO]- | 316.01898 | 173.8 |
[M+CH3COO]- | 330.03463 | 194.7 |
[M+Na-2H]- | 291.99545 | 158.4 |
[M]+ | 271.02023 | 171.7 |
[M]- | 271.02133 | 171.7 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.