CID 4761

Pheniramine

Structural Information

Molecular Formula
C16H20N2
SMILES
CN(C)CCC(C1=CC=CC=C1)C2=CC=CC=N2
InChI
InChI=1S/C16H20N2/c1-18(2)13-11-15(14-8-4-3-5-9-14)16-10-6-7-12-17-16/h3-10,12,15H,11,13H2,1-2H3
InChIKey
IJHNSHDBIRRJRN-UHFFFAOYSA-N
Compound name
N,N-dimethyl-3-phenyl-3-pyridin-2-ylpropan-1-amine
Related CIDs

2D Structure

compound 2d structure
8
Annotation Hits

331
References

17910
Patents

240.16264 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 241.16992 157.6
[M+Na]+ 263.15186 162.3
[M-H]- 239.15536 163.5
[M+NH4]+ 258.19646 173.6
[M+K]+ 279.12580 159.5
[M+H-H2O]+ 223.15990 148.4
[M+HCOO]- 285.16084 180.5
[M+CH3COO]- 299.17649 199.8
[M+Na-2H]- 261.13731 163.2
[M]+ 240.16209 157.7
[M]- 240.16319 157.7
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

No patent data available for this compound.