CID 64400118

1-(2-methoxyphenyl)-4,4-dimethylcyclohexan-1-amine

Structural Information

Molecular Formula
C15H23NO
SMILES
CC1(CCC(CC1)(C2=CC=CC=C2OC)N)C
InChI
InChI=1S/C15H23NO/c1-14(2)8-10-15(16,11-9-14)12-6-4-5-7-13(12)17-3/h4-7H,8-11,16H2,1-3H3
InChIKey
YLUITOWEFILKKS-UHFFFAOYSA-N
Compound name
1-(2-methoxyphenyl)-4,4-dimethylcyclohexan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

233.17796 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 234.185236 155.1
[M+Na]+ 256.167178 161.3
[M-H]- 232.170684 161.1
[M+NH4]+ 251.211783 176.5
[M+K]+ 272.141118 158.5
[M+H-H2O]+ 216.175220 148.9
[M+HCOO]- 278.176161 175.5
[M+CH3COO]- 292.191811 193.8
[M+Na-2H]- 254.152626 159.8
[M]+ 233.17741142 151.5
[M]- 233.17850858 151.5
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.