CID 9619647
518019-34-6
Structural Information
- Molecular Formula
- C17H15Cl2N5O
- SMILES
- C/C(=N\NC(=O)CCN1C2=CC=CC=C2N=N1)/C3=CC(=C(C=C3)Cl)Cl
- InChI
- InChI=1S/C17H15Cl2N5O/c1-11(12-6-7-13(18)14(19)10-12)20-22-17(25)8-9-24-16-5-3-2-4-15(16)21-23-24/h2-7,10H,8-9H2,1H3,(H,22,25)/b20-11+
- InChIKey
- JPONFSCRTSXJIY-RGVLZGJSSA-N
- Compound name
- 3-(benzotriazol-1-yl)-N-[(E)-1-(3,4-dichlorophenyl)ethylideneamino]propanamide
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 376.07265 | 185.3 |
[M+Na]+ | 398.05459 | 195.2 |
[M-H]- | 374.05809 | 190.0 |
[M+NH4]+ | 393.09919 | 197.5 |
[M+K]+ | 414.02853 | 188.0 |
[M+H-H2O]+ | 358.06263 | 175.3 |
[M+HCOO]- | 420.06357 | 198.8 |
[M+CH3COO]- | 434.07922 | 195.3 |
[M+Na-2H]- | 396.04004 | 188.8 |
[M]+ | 375.06482 | 191.5 |
[M]- | 375.06592 | 191.5 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.