CID 2756619

Benzyl-[1-(4-cyclohexylphenyl)ethyl]amine

Structural Information

Molecular Formula
C21H27N
SMILES
CC(C1=CC=C(C=C1)C2CCCCC2)NCC3=CC=CC=C3
InChI
InChI=1S/C21H27N/c1-17(22-16-18-8-4-2-5-9-18)19-12-14-21(15-13-19)20-10-6-3-7-11-20/h2,4-5,8-9,12-15,17,20,22H,3,6-7,10-11,16H2,1H3
InChIKey
HZAOWLFEAUTGPQ-UHFFFAOYSA-N
Compound name
N-benzyl-1-(4-cyclohexylphenyl)ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

293.21436 Da
Monoisotopic Mass

5.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 294.22164 175.8
[M+Na]+ 316.20358 189.3
[M+NH4]+ 311.24818 185.7
[M+K]+ 332.17752 179.3
[M-H]- 292.20708 184.1
[M+Na-2H]- 314.18903 186.2
[M]+ 293.21381 180.2
[M]- 293.21491 180.2
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

No patent data available for this compound.