CID 68606633

1-[(piperidin-2-yl)methyl]cyclohexan-1-ol

Structural Information

Molecular Formula
C12H23NO
SMILES
C1CCC(CC1)(CC2CCCCN2)O
InChI
InChI=1S/C12H23NO/c14-12(7-3-1-4-8-12)10-11-6-2-5-9-13-11/h11,13-14H,1-10H2
InChIKey
QSFIQNPIALHAAI-UHFFFAOYSA-N
Compound name
1-(piperidin-2-ylmethyl)cyclohexan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

197.17796 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 198.18524 150.6
[M+Na]+ 220.16718 151.9
[M-H]- 196.17068 151.1
[M+NH4]+ 215.21178 168.2
[M+K]+ 236.14112 148.7
[M+H-H2O]+ 180.17522 143.5
[M+HCOO]- 242.17616 162.8
[M+CH3COO]- 256.19181 177.3
[M+Na-2H]- 218.15263 153.6
[M]+ 197.17741 138.9
[M]- 197.17851 138.9
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