CID 3056583

Brn 2859343

Structural Information

Molecular Formula
C16H25NO2
SMILES
CN(C)CC1CCCCC1(C2=CC=C(C=C2)OC)O
InChI
InChI=1S/C16H25NO2/c1-17(2)12-14-6-4-5-11-16(14,18)13-7-9-15(19-3)10-8-13/h7-10,14,18H,4-6,11-12H2,1-3H3
InChIKey
OAWLIWXTBJFNDP-UHFFFAOYSA-N
Compound name
2-[(dimethylamino)methyl]-1-(4-methoxyphenyl)cyclohexan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

263.18854 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 264.19582 163.8
[M+Na]+ 286.17776 174.9
[M+NH4]+ 281.22236 173.7
[M+K]+ 302.15170 166.3
[M-H]- 262.18126 168.4
[M+Na-2H]- 284.16321 171.9
[M]+ 263.18799 166.8
[M]- 263.18909 166.8
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