CID 53440147

4h,6h-pyrido[1,2-c][1,3,5]oxadiazine

Structural Information

Molecular Formula
C7H8N2O
SMILES
C1C=CC=C2N1COC=N2
InChI
InChI=1S/C7H8N2O/c1-2-4-9-6-10-5-8-7(9)3-1/h1-3,5H,4,6H2
InChIKey
JXIBWZNIZFYBMQ-UHFFFAOYSA-N
Compound name
4,6-dihydropyrido[1,2-c][1,3,5]oxadiazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

136.06366 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 137.07094 124.0
[M+Na]+ 159.05288 131.8
[M-H]- 135.05638 125.9
[M+NH4]+ 154.09748 142.5
[M+K]+ 175.02682 131.2
[M+H-H2O]+ 119.06092 116.5
[M+HCOO]- 181.06186 142.9
[M+CH3COO]- 195.07751 137.4
[M+Na-2H]- 157.03833 135.3
[M]+ 136.06311 122.1
[M]- 136.06421 122.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.