CID 15103325
99075-24-8
Structural Information
- Molecular Formula
- C10H13NO2
- SMILES
- C1=CC(=CC=C1CCN)CC(=O)O
- InChI
- InChI=1S/C10H13NO2/c11-6-5-8-1-3-9(4-2-8)7-10(12)13/h1-4H,5-7,11H2,(H,12,13)
- InChIKey
- YNRWSYQPUZZUGC-UHFFFAOYSA-N
- Compound name
- 2-[4-(2-aminoethyl)phenyl]acetic acid
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 180.10192 | 139.1 |
[M+Na]+ | 202.08386 | 149.8 |
[M+NH4]+ | 197.12846 | 146.6 |
[M+K]+ | 218.05780 | 144.4 |
[M-H]- | 178.08736 | 140.5 |
[M+Na-2H]- | 200.06931 | 144.5 |
[M]+ | 179.09409 | 140.7 |
[M]- | 179.09519 | 140.7 |
Literature stripe
No literature data available for this compound.