CID 83677359

1,2-oxazole-3-carboximidamide hydrochloride

Structural Information

Molecular Formula
C4H5N3O
SMILES
C1=CON=C1C(=N)N
InChI
InChI=1S/C4H5N3O/c5-4(6)3-1-2-8-7-3/h1-2H,(H3,5,6)
InChIKey
VTYNJTABFCXTBH-UHFFFAOYSA-N
Compound name
1,2-oxazole-3-carboximidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

9
Patents

111.04326 Da
Monoisotopic Mass

-0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 112.05054 118.7
[M+Na]+ 134.03248 126.4
[M-H]- 110.03598 121.6
[M+NH4]+ 129.07708 139.5
[M+K]+ 150.00642 126.6
[M+H-H2O]+ 94.040520 112.2
[M+HCOO]- 156.04146 144.2
[M+CH3COO]- 170.05711 169.8
[M+Na-2H]- 132.01793 126.4
[M]+ 111.04271 116.1
[M]- 111.04381 116.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe