CID 23136243

(2-phenylcyclohexyl)methanamine

Structural Information

Molecular Formula
C13H19N
SMILES
C1CCC(C(C1)CN)C2=CC=CC=C2
InChI
InChI=1S/C13H19N/c14-10-12-8-4-5-9-13(12)11-6-2-1-3-7-11/h1-3,6-7,12-13H,4-5,8-10,14H2
InChIKey
KTGOIKRSPMISTP-UHFFFAOYSA-N
Compound name
(2-phenylcyclohexyl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

18
Patents

189.15175 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 190.15903 145.0
[M+Na]+ 212.14097 157.3
[M+NH4]+ 207.18557 155.1
[M+K]+ 228.11491 149.1
[M-H]- 188.14447 150.8
[M+Na-2H]- 210.12642 153.3
[M]+ 189.15120 148.3
[M]- 189.15230 148.3
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