CID 4394752

3-hydroxy-propionamidine hydrochloride

Structural Information

Molecular Formula
C3H8N2O
SMILES
C(CO)C(=N)N
InChI
InChI=1S/C3H8N2O/c4-3(5)1-2-6/h6H,1-2H2,(H3,4,5)
InChIKey
PFDXDMXJMLPQIL-UHFFFAOYSA-N
Compound name
3-hydroxypropanimidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

145
Patents

88.06366 Da
Monoisotopic Mass

-1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 89.070936 116.3
[M+Na]+ 111.05288 122.7
[M-H]- 87.056384 115.1
[M+NH4]+ 106.09748 138.3
[M+K]+ 127.02682 122.1
[M+H-H2O]+ 71.060920 111.7
[M+HCOO]- 133.06186 140.3
[M+CH3COO]- 147.07751 166.3
[M+Na-2H]- 109.03833 122.4
[M]+ 88.063111 111.9
[M]- 88.064209 111.9
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