CID 3041582
Brn 2301179
Structural Information
- Molecular Formula
- C21H26ClNO2
- SMILES
- CCN(CC)C(=O)C(C)(C)OC1=CC=C(C=C1)CC2=CC=C(C=C2)Cl
- InChI
- InChI=1S/C21H26ClNO2/c1-5-23(6-2)20(24)21(3,4)25-19-13-9-17(10-14-19)15-16-7-11-18(22)12-8-16/h7-14H,5-6,15H2,1-4H3
- InChIKey
- HAOQHDCDWKXSHN-UHFFFAOYSA-N
- Compound name
- 2-[4-[(4-chlorophenyl)methyl]phenoxy]-N,N-diethyl-2-methylpropanamide
- Related CIDs
2D Structure
Profile
Predicted Collision Cross Section
Adduct | m/z | Predicted CCS (Ų) |
---|---|---|
[M+H]+ | 360.17248 | 187.7 |
[M+Na]+ | 382.15442 | 193.6 |
[M-H]- | 358.15792 | 195.2 |
[M+NH4]+ | 377.19902 | 201.7 |
[M+K]+ | 398.12836 | 189.2 |
[M+H-H2O]+ | 342.16246 | 179.9 |
[M+HCOO]- | 404.16340 | 204.8 |
[M+CH3COO]- | 418.17905 | 220.9 |
[M+Na-2H]- | 380.13987 | 189.3 |
[M]+ | 359.16465 | 193.9 |
[M]- | 359.16575 | 193.9 |
Literature stripe
No literature data available for this compound.
Patent stripe
No patent data available for this compound.