CID 13371190

95298-76-3

Structural Information

Molecular Formula
C4H5N3O2
SMILES
C1=NOC(=C1C(=O)N)N
InChI
InChI=1S/C4H5N3O2/c5-3(8)2-1-7-9-4(2)6/h1H,6H2,(H2,5,8)
InChIKey
BQEXBKQAUDVIGC-UHFFFAOYSA-N
Compound name
5-amino-1,2-oxazole-4-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

127.03818 Da
Monoisotopic Mass

-0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 128.045456 121.7
[M+Na]+ 150.027398 130.3
[M-H]- 126.030904 124.5
[M+NH4]+ 145.072003 141.8
[M+K]+ 166.001338 130.6
[M+H-H2O]+ 110.035440 115.3
[M+HCOO]- 172.036381 146.8
[M+CH3COO]- 186.052031 172.6
[M+Na-2H]- 148.012846 127.7
[M]+ 127.03763142 119.9
[M]- 127.03872858 119.9
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