CID 49745
Brn 3476920
Structural Information
- Molecular Formula
- C14H10Cl2N2O5
- SMILES
- C1=CC=C(C(=C1)C(OC(C2=CC=CC=C2[N+](=O)[O-])Cl)Cl)[N+](=O)[O-]
- InChI
- InChI=1S/C14H10Cl2N2O5/c15-13(9-5-1-3-7-11(9)17(19)20)23-14(16)10-6-2-4-8-12(10)18(21)22/h1-8,13-14H
- InChIKey
- WGPAGWJJNNQKQP-UHFFFAOYSA-N
- Compound name
- 1-[chloro-[chloro-(2-nitrophenyl)methoxy]methyl]-2-nitrobenzene
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 357.00395 | 178.7 |
[M+Na]+ | 378.98589 | 182.5 |
[M-H]- | 354.98939 | 183.3 |
[M+NH4]+ | 374.03049 | 189.5 |
[M+K]+ | 394.95983 | 171.0 |
[M+H-H2O]+ | 338.99393 | 181.4 |
[M+HCOO]- | 400.99487 | 192.7 |
[M+CH3COO]- | 415.01052 | 199.6 |
[M+Na-2H]- | 376.97134 | 182.9 |
[M]+ | 355.99612 | 179.6 |
[M]- | 355.99722 | 179.6 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.