CID 22612
6241-46-9
Structural Information
- Molecular Formula
- C9H13ClN2
- SMILES
- C1=CC=C(C(=C1)CNCCN)Cl
- InChI
- InChI=1S/C9H13ClN2/c10-9-4-2-1-3-8(9)7-12-6-5-11/h1-4,12H,5-7,11H2
- InChIKey
- WTGFJEQTHKHUID-UHFFFAOYSA-N
- Compound name
- N'-[(2-chlorophenyl)methyl]ethane-1,2-diamine
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 185.08400 | 139.1 |
[M+Na]+ | 207.06594 | 146.5 |
[M-H]- | 183.06944 | 142.0 |
[M+NH4]+ | 202.11054 | 159.1 |
[M+K]+ | 223.03988 | 142.0 |
[M+H-H2O]+ | 167.07398 | 133.8 |
[M+HCOO]- | 229.07492 | 160.4 |
[M+CH3COO]- | 243.09057 | 185.4 |
[M+Na-2H]- | 205.05139 | 145.5 |
[M]+ | 184.07617 | 138.8 |
[M]- | 184.07727 | 138.8 |
Literature stripe
No literature data available for this compound.