CID 71742952

5-chloro-1h-pyrido[3,4-b][1,4]oxazin-2(3h)-one

Structural Information

Molecular Formula
C7H5ClN2O2
SMILES
C1C(=O)NC2=C(O1)C(=NC=C2)Cl
InChI
InChI=1S/C7H5ClN2O2/c8-7-6-4(1-2-9-7)10-5(11)3-12-6/h1-2H,3H2,(H,10,11)
InChIKey
FHNIOFLISORNMS-UHFFFAOYSA-N
Compound name
5-chloro-1H-pyrido[3,4-b][1,4]oxazin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

184.00395 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 185.01123 133.0
[M+Na]+ 206.99317 147.6
[M+NH4]+ 202.03777 141.5
[M+K]+ 222.96711 141.4
[M-H]- 182.99667 135.3
[M+Na-2H]- 204.97862 138.6
[M]+ 184.00340 135.9
[M]- 184.00450 135.9
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.