CID 2763950

35261-06-4

Structural Information

Molecular Formula
C5H7N3O2
SMILES
CC1=NOC(=C1C(=O)N)N
InChI
InChI=1S/C5H7N3O2/c1-2-3(4(6)9)5(7)10-8-2/h7H2,1H3,(H2,6,9)
InChIKey
KDSCHAHLJUDMHT-UHFFFAOYSA-N
Compound name
5-amino-3-methyl-1,2-oxazole-4-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

50
Patents

141.05383 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 142.06111 126.6
[M+Na]+ 164.04305 135.7
[M-H]- 140.04655 129.6
[M+NH4]+ 159.08765 146.5
[M+K]+ 180.01699 135.7
[M+H-H2O]+ 124.05109 120.4
[M+HCOO]- 186.05203 151.3
[M+CH3COO]- 200.06768 176.9
[M+Na-2H]- 162.02850 131.3
[M]+ 141.05328 125.5
[M]- 141.05438 125.5
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