CID 200680

1-(p-chlorophenyl)-2-((dimethylamino)methyl)cyclohexanol hydrochloride

Structural Information

Molecular Formula
C15H22ClNO
SMILES
CN(C)CC1CCCCC1(C2=CC=C(C=C2)Cl)O
InChI
InChI=1S/C15H22ClNO/c1-17(2)11-13-5-3-4-10-15(13,18)12-6-8-14(16)9-7-12/h6-9,13,18H,3-5,10-11H2,1-2H3
InChIKey
INBTUPOBAFCZTO-UHFFFAOYSA-N
Compound name
1-(4-chlorophenyl)-2-[(dimethylamino)methyl]cyclohexan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

267.13898 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 268.14626 161.8
[M+Na]+ 290.12820 174.4
[M+NH4]+ 285.17280 172.6
[M+K]+ 306.10214 164.6
[M-H]- 266.13170 167.0
[M+Na-2H]- 288.11365 170.7
[M]+ 267.13843 165.5
[M]- 267.13953 165.5
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

patents stripe