CID 22319463

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

Structural Information

Molecular Formula

C₈H₁₀N₂O

SMILES

CC1=NC2=C(C=C1)OCCN2

InChI

InChI=1S/C8H10N2O/c1-6-2-3-7-8(10-6)9-4-5-11-7/h2-3H,4-5H2,1H3,(H,9,10)

InChIKey

FFTDFJXFRVXAGD-UHFFFAOYSA-N

Compound name

6-methyl-3,4-dihydro-2H-pyrido[3,2-b][1,4]oxazine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 78
Patents: 150.07932 Da
Monoisotopic Mass: 1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	151.086596	129.7
[M+Na]+	173.068538	137.7
[M-H]-	149.072044	130.5
[M+NH4]+	168.113143	147.4
[M+K]+	189.042478	135.9
[M+H-H2O]+	133.076580	122.6
[M+HCOO]-	195.077521	146.8
[M+CH3COO]-	209.093171	142.3
[M+Na-2H]-	171.053986	139.3
[M]+	150.07877142	126.8
[M]-	150.07986858	126.8

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe