CID 3056577

Brn 2849467

Structural Information

Molecular Formula
C16H25NO
SMILES
CN(C)CC1CCCCC1C2=CC(=CC=C2)OC
InChI
InChI=1S/C16H25NO/c1-17(2)12-14-7-4-5-10-16(14)13-8-6-9-15(11-13)18-3/h6,8-9,11,14,16H,4-5,7,10,12H2,1-3H3
InChIKey
VTXTVLAQPBIPPF-UHFFFAOYSA-N
Compound name
1-[2-(3-methoxyphenyl)cyclohexyl]-N,N-dimethylmethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

88
Patents

247.19362 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 248.20090 160.7
[M+Na]+ 270.18284 172.8
[M+NH4]+ 265.22744 170.1
[M+K]+ 286.15678 164.9
[M-H]- 246.18634 166.4
[M+Na-2H]- 268.16829 168.3
[M]+ 247.19307 164.1
[M]- 247.19417 164.1
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