CID 43133157

[1-(2-amino-4-chlorophenyl)piperidin-4-yl]methanol

Structural Information

Molecular Formula
C12H17ClN2O
SMILES
C1CN(CCC1CO)C2=C(C=C(C=C2)Cl)N
InChI
InChI=1S/C12H17ClN2O/c13-10-1-2-12(11(14)7-10)15-5-3-9(8-16)4-6-15/h1-2,7,9,16H,3-6,8,14H2
InChIKey
RKBDEYDDNCNVHV-UHFFFAOYSA-N
Compound name
[1-(2-amino-4-chlorophenyl)piperidin-4-yl]methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

18
Patents

240.10294 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 241.11022 153.1
[M+Na]+ 263.09216 165.8
[M+NH4]+ 258.13676 161.7
[M+K]+ 279.06610 158.5
[M-H]- 239.09566 157.1
[M+Na-2H]- 261.07761 159.8
[M]+ 240.10239 156.2
[M]- 240.10349 156.2
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