CID 3067126
3-(4-methylphenoxy)benzyl 2-(4-chlorophenyl)-2-methylpropyl ether
Structural Information
- Molecular Formula
- C24H25ClO2
- SMILES
- CC1=CC=C(C=C1)OC2=CC=CC(=C2)COCC(C)(C)C3=CC=C(C=C3)Cl
- InChI
- InChI=1S/C24H25ClO2/c1-18-7-13-22(14-8-18)27-23-6-4-5-19(15-23)16-26-17-24(2,3)20-9-11-21(25)12-10-20/h4-15H,16-17H2,1-3H3
- InChIKey
- BMQJXWPUEJXPLM-UHFFFAOYSA-N
- Compound name
- 1-chloro-4-[2-methyl-1-[[3-(4-methylphenoxy)phenyl]methoxy]propan-2-yl]benzene
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 381.16158 | 193.7 |
[M+Na]+ | 403.14352 | 201.1 |
[M-H]- | 379.14702 | 202.9 |
[M+NH4]+ | 398.18812 | 206.2 |
[M+K]+ | 419.11746 | 194.4 |
[M+H-H2O]+ | 363.15156 | 184.5 |
[M+HCOO]- | 425.15250 | 210.0 |
[M+CH3COO]- | 439.16815 | 219.2 |
[M+Na-2H]- | 401.12897 | 196.7 |
[M]+ | 380.15375 | 199.3 |
[M]- | 380.15485 | 199.3 |
Literature stripe
No literature data available for this compound.