CID 57880531

4-(pyrazin-2-yl)piperidin-4-ol dihydrochloride

Structural Information

Molecular Formula
C9H13N3O
SMILES
C1CNCCC1(C2=NC=CN=C2)O
InChI
InChI=1S/C9H13N3O/c13-9(1-3-10-4-2-9)8-7-11-5-6-12-8/h5-7,10,13H,1-4H2
InChIKey
UMZWDQLOOQTUCN-UHFFFAOYSA-N
Compound name
4-pyrazin-2-ylpiperidin-4-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

179.10587 Da
Monoisotopic Mass

-1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 180.11315 140.8
[M+Na]+ 202.09509 146.6
[M-H]- 178.09859 140.0
[M+NH4]+ 197.13969 156.6
[M+K]+ 218.06903 143.0
[M+H-H2O]+ 162.10313 132.3
[M+HCOO]- 224.10407 155.7
[M+CH3COO]- 238.11972 151.1
[M+Na-2H]- 200.08054 148.5
[M]+ 179.10532 133.4
[M]- 179.10642 133.4
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