CID 55720

87498-60-0

Structural Information

Molecular Formula
C15H24N2
SMILES
CC(CC1=CC=CC=C1)NN2CCCCCC2
InChI
InChI=1S/C15H24N2/c1-14(13-15-9-5-4-6-10-15)16-17-11-7-2-3-8-12-17/h4-6,9-10,14,16H,2-3,7-8,11-13H2,1H3
InChIKey
HDRDMYCGSLKJNT-UHFFFAOYSA-N
Compound name
N-(1-phenylpropan-2-yl)azepan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

232.19395 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 233.20123 157.3
[M+Na]+ 255.18317 166.3
[M+NH4]+ 250.22777 165.1
[M+K]+ 271.15711 160.4
[M-H]- 231.18667 161.3
[M+Na-2H]- 253.16862 164.4
[M]+ 232.19340 159.6
[M]- 232.19450 159.6
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.