CID 13196546

2,2-dimethyl-2h,3h,4h-pyrido[3,2-b][1,4]oxazine

Structural Information

Molecular Formula
C9H12N2O
SMILES
CC1(CNC2=C(O1)C=CC=N2)C
InChI
InChI=1S/C9H12N2O/c1-9(2)6-11-8-7(12-9)4-3-5-10-8/h3-5H,6H2,1-2H3,(H,10,11)
InChIKey
DEYCWKUHWUXFCX-UHFFFAOYSA-N
Compound name
2,2-dimethyl-3,4-dihydropyrido[3,2-b][1,4]oxazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

164.09496 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 165.102236 134.3
[M+Na]+ 187.084178 142.8
[M-H]- 163.087684 135.4
[M+NH4]+ 182.128783 153.5
[M+K]+ 203.058118 141.1
[M+H-H2O]+ 147.092220 127.5
[M+HCOO]- 209.093161 151.1
[M+CH3COO]- 223.108811 147.0
[M+Na-2H]- 185.069626 144.3
[M]+ 164.09441142 132.1
[M]- 164.09550858 132.1
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

patents stripe