CID 69188689

6,7-dihydro-5h-pyrazolo[5,1-b][1,3]oxazine

Structural Information

Molecular Formula
C6H8N2O
SMILES
C1CN2C(=CC=N2)OC1
InChI
InChI=1S/C6H8N2O/c1-4-8-6(9-5-1)2-3-7-8/h2-3H,1,4-5H2
InChIKey
IASRYLKZYZPWRV-UHFFFAOYSA-N
Compound name
6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

256
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 121.0
[M+Na]+ 147.05288 129.2
[M-H]- 123.05638 123.1
[M+NH4]+ 142.09748 141.9
[M+K]+ 163.02682 129.2
[M+H-H2O]+ 107.06092 114.3
[M+HCOO]- 169.06186 141.1
[M+CH3COO]- 183.07751 135.1
[M+Na-2H]- 145.03833 130.1
[M]+ 124.06311 119.6
[M]- 124.06421 119.6
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

patents stripe