CID 4722369

110931-72-1

Structural Information

Molecular Formula
C14H15N
SMILES
CNCC1=CC=C(C=C1)C2=CC=CC=C2
InChI
InChI=1S/C14H15N/c1-15-11-12-7-9-14(10-8-12)13-5-3-2-4-6-13/h2-10,15H,11H2,1H3
InChIKey
GZUHCAWQWUONPS-UHFFFAOYSA-N
Compound name
N-methyl-1-(4-phenylphenyl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

128
Patents

197.12045 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 198.12773 145.0
[M+Na]+ 220.10967 160.2
[M+NH4]+ 215.15427 155.3
[M+K]+ 236.08361 150.9
[M-H]- 196.11317 151.5
[M+Na-2H]- 218.09512 156.3
[M]+ 197.11990 149.2
[M]- 197.12100 149.2
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