CID 33728543

(3-aminopyrazin-2-yl)methanol

Structural Information

Molecular Formula
C5H7N3O
SMILES
C1=CN=C(C(=N1)CO)N
InChI
InChI=1S/C5H7N3O/c6-5-4(3-9)7-1-2-8-5/h1-2,9H,3H2,(H2,6,8)
InChIKey
SWPAJZUYMOWGDH-UHFFFAOYSA-N
Compound name
(3-aminopyrazin-2-yl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

57
Patents

125.058914 Da
Monoisotopic Mass

-0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 126.06619 122.9
[M+Na]+ 148.04813 131.8
[M-H]- 124.05164 122.6
[M+NH4]+ 143.09274 141.5
[M+K]+ 164.02207 129.7
[M+H-H2O]+ 108.05617 116.2
[M+HCOO]- 170.05712 145.4
[M+CH3COO]- 184.07276 169.3
[M+Na-2H]- 146.03358 131.4
[M]+ 125.05837 120.6
[M]- 125.05946 120.6
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