CID 3052543

68968-10-5

Structural Information

Molecular Formula
C14H21N
SMILES
C1CCC(CC1)C(CC2=CC=CC=C2)N
InChI
InChI=1S/C14H21N/c15-14(13-9-5-2-6-10-13)11-12-7-3-1-4-8-12/h1,3-4,7-8,13-14H,2,5-6,9-11,15H2
InChIKey
PAAMSJPFJXVEGL-UHFFFAOYSA-N
Compound name
1-cyclohexyl-2-phenylethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

24
Patents

203.1674 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 204.17468 150.2
[M+Na]+ 226.15662 161.5
[M+NH4]+ 221.20122 159.9
[M+K]+ 242.13056 153.7
[M-H]- 202.16012 155.6
[M+Na-2H]- 224.14207 158.0
[M]+ 203.16685 153.2
[M]- 203.16795 153.2
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