CID 16227779

21080-91-1

Structural Information

Molecular Formula
C6H8N2O
SMILES
C1CC1C2=NOC(=C2)N
InChI
InChI=1S/C6H8N2O/c7-6-3-5(8-9-6)4-1-2-4/h3-4H,1-2,7H2
InChIKey
HAFQCGUIQVGCKG-UHFFFAOYSA-N
Compound name
3-cyclopropyl-1,2-oxazol-5-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

106
Patents

124.06366 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 125.07094 122.3
[M+Na]+ 147.05288 133.0
[M-H]- 123.05638 129.3
[M+NH4]+ 142.09748 138.5
[M+K]+ 163.02682 131.5
[M+H-H2O]+ 107.06092 115.7
[M+HCOO]- 169.06186 147.1
[M+CH3COO]- 183.07751 174.4
[M+Na-2H]- 145.03833 129.6
[M]+ 124.06311 124.2
[M]- 124.06421 124.2
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