CID 12949918

2936-63-2

Structural Information

Molecular Formula
C17H15N
SMILES
C1=CC=C(C=C1)C(C2=CC=CC3=CC=CC=C32)N
InChI
InChI=1S/C17H15N/c18-17(14-8-2-1-3-9-14)16-12-6-10-13-7-4-5-11-15(13)16/h1-12,17H,18H2
InChIKey
MKYLPACDIKGXSW-UHFFFAOYSA-N
Compound name
naphthalen-1-yl(phenyl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

87
Patents

233.12045 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 234.12773 152.4
[M+Na]+ 256.10967 159.0
[M-H]- 232.11317 159.2
[M+NH4]+ 251.15427 170.3
[M+K]+ 272.08361 153.6
[M+H-H2O]+ 216.11771 144.7
[M+HCOO]- 278.11865 175.0
[M+CH3COO]- 292.13430 164.5
[M+Na-2H]- 254.09512 159.6
[M]+ 233.11990 149.3
[M]- 233.12100 149.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe