CID 3057512

74050-96-7

Structural Information

Molecular Formula
C16H19ClN2O
SMILES
CN(C)CCC(C1=CC=C(C=C1)Cl)(C2=CC=CC=N2)O
InChI
InChI=1S/C16H19ClN2O/c1-19(2)12-10-16(20,15-5-3-4-11-18-15)13-6-8-14(17)9-7-13/h3-9,11,20H,10,12H2,1-2H3
InChIKey
KMXNKRXQXACHDF-UHFFFAOYSA-N
Compound name
1-(4-chlorophenyl)-3-(dimethylamino)-1-pyridin-2-ylpropan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

290.1186 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 291.12588 168.5
[M+Na]+ 313.10782 182.6
[M+NH4]+ 308.15242 176.8
[M+K]+ 329.08176 174.8
[M-H]- 289.11132 172.7
[M+Na-2H]- 311.09327 177.8
[M]+ 290.11805 172.2
[M]- 290.11915 172.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe