CID 96581940

(3s)-3-methyl-1h,2h,3h-pyrido[2,3-b][1,4]oxazine

Structural Information

Molecular Formula
C8H10N2O
SMILES
C[C@H]1CNC2=C(O1)N=CC=C2
InChI
InChI=1S/C8H10N2O/c1-6-5-10-7-3-2-4-9-8(7)11-6/h2-4,6,10H,5H2,1H3/t6-/m0/s1
InChIKey
IKZOSGDTRVGYJU-LURJTMIESA-N
Compound name
(3S)-3-methyl-2,3-dihydro-1H-pyrido[2,3-b][1,4]oxazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

150.07932 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 151.08660 129.7
[M+Na]+ 173.06854 137.7
[M-H]- 149.07204 130.5
[M+NH4]+ 168.11314 147.4
[M+K]+ 189.04248 135.9
[M+H-H2O]+ 133.07658 122.6
[M+HCOO]- 195.07752 146.8
[M+CH3COO]- 209.09317 142.3
[M+Na-2H]- 171.05399 139.3
[M]+ 150.07877 126.8
[M]- 150.07987 126.8
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.