CID 65440656

(3-methyl-4-phenylphenyl)methanamine

Structural Information

Molecular Formula
C14H15N
SMILES
CC1=C(C=CC(=C1)CN)C2=CC=CC=C2
InChI
InChI=1S/C14H15N/c1-11-9-12(10-15)7-8-14(11)13-5-3-2-4-6-13/h2-9H,10,15H2,1H3
InChIKey
GTDPGPWRQIYZHO-UHFFFAOYSA-N
Compound name
(3-methyl-4-phenylphenyl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

15
Patents

197.12045 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 198.12773 143.7
[M+Na]+ 220.10967 151.5
[M-H]- 196.11317 150.3
[M+NH4]+ 215.15427 162.8
[M+K]+ 236.08361 147.2
[M+H-H2O]+ 180.11771 136.8
[M+HCOO]- 242.11865 168.6
[M+CH3COO]- 256.13430 188.5
[M+Na-2H]- 218.09512 149.8
[M]+ 197.11990 141.9
[M]- 197.12100 141.9
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