CID 40324
Nrdc 140
Structural Information
- Molecular Formula
- C20H20Cl2O3
- SMILES
- CC1([C@@H]([C@H]1C(=O)OCC2=COC(=C2)CC3=CC=CC=C3)C=C(Cl)Cl)C
- InChI
- InChI=1S/C20H20Cl2O3/c1-20(2)16(10-17(21)22)18(20)19(23)25-12-14-9-15(24-11-14)8-13-6-4-3-5-7-13/h3-7,9-11,16,18H,8,12H2,1-2H3/t16-,18+/m1/s1
- InChIKey
- NKISTTWJULDICJ-AEFFLSMTSA-N
- Compound name
- (5-benzylfuran-3-yl)methyl (1R,3S)-3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropane-1-carboxylate
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 379.08623 | 179.1 |
[M+Na]+ | 401.06817 | 188.9 |
[M-H]- | 377.07167 | 189.2 |
[M+NH4]+ | 396.11277 | 190.3 |
[M+K]+ | 417.04211 | 183.7 |
[M+H-H2O]+ | 361.07621 | 174.0 |
[M+HCOO]- | 423.07715 | 190.9 |
[M+CH3COO]- | 437.09280 | 215.8 |
[M+Na-2H]- | 399.05362 | 178.8 |
[M]+ | 378.07840 | 188.9 |
[M]- | 378.07950 | 188.9 |
Literature stripe
No literature data available for this compound.