CID 3044131

4-methyl-4-phenyl-2-cyclohexen-1-amine hydrochloride

Structural Information

Molecular Formula
C13H17N
SMILES
CC1(CCC(C=C1)N)C2=CC=CC=C2
InChI
InChI=1S/C13H17N/c1-13(9-7-12(14)8-10-13)11-5-3-2-4-6-11/h2-7,9,12H,8,10,14H2,1H3
InChIKey
DNELWBHKBFCDKS-UHFFFAOYSA-N
Compound name
4-methyl-4-phenylcyclohex-2-en-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

187.1361 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 188.14338 143.3
[M+Na]+ 210.12532 156.7
[M+NH4]+ 205.16992 154.9
[M+K]+ 226.09926 146.7
[M-H]- 186.12882 149.3
[M+Na-2H]- 208.11077 154.1
[M]+ 187.13555 147.2
[M]- 187.13665 147.2
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.