CID 46155
Brn 3472087
Structural Information
- Molecular Formula
- C22H20Cl2O2
- SMILES
- CC1=CC(=C(C=C1CC2=C(C=CC(=C2)Cl)O)CC3=C(C=CC(=C3)Cl)O)C
- InChI
- InChI=1S/C22H20Cl2O2/c1-13-7-14(2)16(10-18-12-20(24)4-6-22(18)26)8-15(13)9-17-11-19(23)3-5-21(17)25/h3-8,11-12,25-26H,9-10H2,1-2H3
- InChIKey
- YSJLJKTZENIOHB-UHFFFAOYSA-N
- Compound name
- 4-chloro-2-[[5-[(5-chloro-2-hydroxyphenyl)methyl]-2,4-dimethylphenyl]methyl]phenol
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 387.09133 | 188.6 |
[M+Na]+ | 409.07327 | 199.6 |
[M-H]- | 385.07677 | 195.9 |
[M+NH4]+ | 404.11787 | 201.3 |
[M+K]+ | 425.04721 | 190.7 |
[M+H-H2O]+ | 369.08131 | 181.8 |
[M+HCOO]- | 431.08225 | 199.3 |
[M+CH3COO]- | 445.09790 | 217.0 |
[M+Na-2H]- | 407.05872 | 187.7 |
[M]+ | 386.08350 | 193.7 |
[M]- | 386.08460 | 193.7 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.