CID 14858455

5-methoxy-3,6-dihydro-2h-oxazine

Structural Information

Molecular Formula
C5H9NO2
SMILES
COC1=NCCOC1
InChI
InChI=1S/C5H9NO2/c1-7-5-4-8-3-2-6-5/h2-4H2,1H3
InChIKey
VDRWGEPHOPCAAB-UHFFFAOYSA-N
Compound name
5-methoxy-3,6-dihydro-2H-1,4-oxazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

48
Patents

115.06333 Da
Monoisotopic Mass

-0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 116.07061 119.9
[M+Na]+ 138.05255 127.1
[M-H]- 114.05605 122.6
[M+NH4]+ 133.09715 139.9
[M+K]+ 154.02649 128.6
[M+H-H2O]+ 98.060590 113.9
[M+HCOO]- 160.06153 141.2
[M+CH3COO]- 174.07718 165.8
[M+Na-2H]- 136.03800 129.3
[M]+ 115.06278 119.5
[M]- 115.06388 119.5
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