CID 16793090

(2-{4-[(dimethylamino)methyl]phenyl}phenyl)methanamine

Structural Information

Molecular Formula
C16H20N2
SMILES
CN(C)CC1=CC=C(C=C1)C2=CC=CC=C2CN
InChI
InChI=1S/C16H20N2/c1-18(2)12-13-7-9-14(10-8-13)16-6-4-3-5-15(16)11-17/h3-10H,11-12,17H2,1-2H3
InChIKey
HKNWTQBRDQXKPW-UHFFFAOYSA-N
Compound name
[2-[4-[(dimethylamino)methyl]phenyl]phenyl]methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

240.16264 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 241.169916 157.3
[M+Na]+ 263.151858 163.4
[M-H]- 239.155364 164.8
[M+NH4]+ 258.196463 174.8
[M+K]+ 279.125798 160.0
[M+H-H2O]+ 223.159900 149.2
[M+HCOO]- 285.160841 183.0
[M+CH3COO]- 299.176491 202.9
[M+Na-2H]- 261.137306 161.8
[M]+ 240.16209142 156.7
[M]- 240.16318858 156.7
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

patents stripe