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

150
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]+ 111.052878 122.7
[M-H]- 87.056384 115.1
[M+NH4]+ 106.097483 138.3
[M+K]+ 127.026818 122.1
[M+H-H2O]+ 71.060920 111.7
[M+HCOO]- 133.061861 140.3
[M+CH3COO]- 147.077511 166.3
[M+Na-2H]- 109.038326 122.4
[M]+ 88.06311142 111.9
[M]- 88.06420858 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