CID 22744473

4-(hydroxymethyl)piperidin-4-ol hydrochloride

Structural Information

Molecular Formula
C6H13NO2
SMILES
C1CNCCC1(CO)O
InChI
InChI=1S/C6H13NO2/c8-5-6(9)1-3-7-4-2-6/h7-9H,1-5H2
InChIKey
BCOGPFMRSSZIFM-UHFFFAOYSA-N
Compound name
4-(hydroxymethyl)piperidin-4-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

287
Patents

131.09464 Da
Monoisotopic Mass

-1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 132.10192 129.3
[M+Na]+ 154.08386 134.5
[M-H]- 130.08736 126.9
[M+NH4]+ 149.12846 149.5
[M+K]+ 170.05780 132.4
[M+H-H2O]+ 114.09190 124.6
[M+HCOO]- 176.09284 145.1
[M+CH3COO]- 190.10849 161.8
[M+Na-2H]- 152.06931 135.6
[M]+ 131.09409 121.9
[M]- 131.09519 121.9
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