CID 23042899

5,6-dihydro-4h-1,3-oxazin-2-amine

Structural Information

Molecular Formula
C4H8N2O
SMILES
C1CN=C(OC1)N
InChI
InChI=1S/C4H8N2O/c5-4-6-2-1-3-7-4/h1-3H2,(H2,5,6)
InChIKey
VPVZSRIIAONGMU-UHFFFAOYSA-N
Compound name
5,6-dihydro-4H-1,3-oxazin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

120
Patents

100.06366 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 101.07094 117.1
[M+Na]+ 123.05288 123.8
[M-H]- 99.056384 119.3
[M+NH4]+ 118.09748 137.0
[M+K]+ 139.02682 124.5
[M+H-H2O]+ 83.060920 110.9
[M+HCOO]- 145.06186 138.8
[M+CH3COO]- 159.07751 165.5
[M+Na-2H]- 121.03833 126.2
[M]+ 100.06311 113.1
[M]- 100.06421 113.1
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