CID 55254217
At45568
Structural Information
- Molecular Formula
- C9H12ClNO
- SMILES
- COC1=CC=CC(=C1Cl)CCN
- InChI
- InChI=1S/C9H12ClNO/c1-12-8-4-2-3-7(5-6-11)9(8)10/h2-4H,5-6,11H2,1H3
- InChIKey
- XWIMGFWLODVBLU-UHFFFAOYSA-N
- Compound name
- 2-(2-chloro-3-methoxyphenyl)ethanamine
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 186.06803 | 137.6 |
[M+Na]+ | 208.04997 | 146.8 |
[M-H]- | 184.05347 | 141.0 |
[M+NH4]+ | 203.09457 | 158.3 |
[M+K]+ | 224.02391 | 143.0 |
[M+H-H2O]+ | 168.05801 | 132.8 |
[M+HCOO]- | 230.05895 | 158.2 |
[M+CH3COO]- | 244.07460 | 183.6 |
[M+Na-2H]- | 206.03542 | 143.1 |
[M]+ | 185.06020 | 139.9 |
[M]- | 185.06130 | 139.9 |
Literature stripe
No literature data available for this compound.