CID 29152

2-(p-chlorodiphenylmethoxy)-n,n-dimethylethylamine hydrochloride

Structural Information

Molecular Formula
C17H20ClNO
SMILES
CN(C)CCOC(C1=CC=CC=C1)C2=CC=C(C=C2)Cl
InChI
InChI=1S/C17H20ClNO/c1-19(2)12-13-20-17(14-6-4-3-5-7-14)15-8-10-16(18)11-9-15/h3-11,17H,12-13H2,1-2H3
InChIKey
CYTJSDVBPCRZFB-UHFFFAOYSA-N
Compound name
2-[(4-chlorophenyl)-phenylmethoxy]-N,N-dimethylethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

0
Patents

289.12335 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 290.13063 168.0
[M+Na]+ 312.11257 174.0
[M-H]- 288.11607 175.3
[M+NH4]+ 307.15717 184.5
[M+K]+ 328.08651 169.8
[M+H-H2O]+ 272.12061 160.3
[M+HCOO]- 334.12155 187.5
[M+CH3COO]- 348.13720 207.0
[M+Na-2H]- 310.09802 171.5
[M]+ 289.12280 172.1
[M]- 289.12390 172.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe