CID 14388559

5-methoxy-1h-pyrazol-3-amine hydrochloride

Structural Information

Molecular Formula
C4H7N3O
SMILES
COC1=NNC(=C1)N
InChI
InChI=1S/C4H7N3O/c1-8-4-2-3(5)6-7-4/h2H,1H3,(H3,5,6,7)
InChIKey
DSFUCCQCXNNWLA-UHFFFAOYSA-N
Compound name
3-methoxy-1H-pyrazol-5-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

142
Patents

113.058914 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 114.06619 119.4
[M+Na]+ 136.04813 128.4
[M-H]- 112.05164 119.1
[M+NH4]+ 131.09274 140.2
[M+K]+ 152.02207 127.0
[M+H-H2O]+ 96.056174 112.8
[M+HCOO]- 158.05712 142.8
[M+CH3COO]- 172.07276 166.3
[M+Na-2H]- 134.03358 125.9
[M]+ 113.05837 117.3
[M]- 113.05946 117.3
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