CID 286110
1,4-methanonaphthalene-5,8-dione, 1,2,3,4-tetrachloro-1,4,4a,8a-tetrahydro-9,9-dimethoxy-
Structural Information
- Molecular Formula
- C13H10Cl4O4
- SMILES
- COC1(C2(C3C(C1(C(=C2Cl)Cl)Cl)C(=O)C=CC3=O)Cl)OC
- InChI
- InChI=1S/C13H10Cl4O4/c1-20-13(21-2)11(16)7-5(18)3-4-6(19)8(7)12(13,17)10(15)9(11)14/h3-4,7-8H,1-2H3
- InChIKey
- DCGCFQBJRLWZID-UHFFFAOYSA-N
- Compound name
- 1,8,9,10-tetrachloro-11,11-dimethoxytricyclo[6.2.1.02,7]undeca-4,9-diene-3,6-dione
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 370.94060 | 171.4 |
[M+Na]+ | 392.92254 | 185.6 |
[M-H]- | 368.92604 | 173.7 |
[M+NH4]+ | 387.96714 | 196.6 |
[M+K]+ | 408.89648 | 178.5 |
[M+H-H2O]+ | 352.93058 | 172.0 |
[M+HCOO]- | 414.93152 | 172.1 |
[M+CH3COO]- | 428.94717 | 211.7 |
[M+Na-2H]- | 390.90799 | 173.5 |
[M]+ | 369.93277 | 178.3 |
[M]- | 369.93387 | 178.3 |
Literature stripe
No literature data available for this compound.