CID 12730640

2-ethoxy-4,5-dihydro-1,3-oxazole

Structural Information

Molecular Formula
C5H9NO2
SMILES
CCOC1=NCCO1
InChI
InChI=1S/C5H9NO2/c1-2-7-5-6-3-4-8-5/h2-4H2,1H3
InChIKey
MTYHIWQZNFDCJT-UHFFFAOYSA-N
Compound name
2-ethoxy-4,5-dihydro-1,3-oxazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

206
Patents

115.06333 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 116.07061 120.8
[M+Na]+ 138.05255 131.9
[M+NH4]+ 133.09715 129.2
[M+K]+ 154.02649 128.7
[M-H]- 114.05605 122.6
[M+Na-2H]- 136.03800 125.9
[M]+ 115.06278 122.7
[M]- 115.06388 122.7
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