CID 79145709

[5-(methoxymethyl)-1,3-oxazol-4-yl]methanol

Structural Information

Molecular Formula
C6H9NO3
SMILES
COCC1=C(N=CO1)CO
InChI
InChI=1S/C6H9NO3/c1-9-3-6-5(2-8)7-4-10-6/h4,8H,2-3H2,1H3
InChIKey
SQWAVXCDIXIGGY-UHFFFAOYSA-N
Compound name
[5-(methoxymethyl)-1,3-oxazol-4-yl]methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

143.05824 Da
Monoisotopic Mass

-0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 144.06552 125.6
[M+Na]+ 166.04746 134.6
[M-H]- 142.05096 127.6
[M+NH4]+ 161.09206 145.8
[M+K]+ 182.02140 135.1
[M+H-H2O]+ 126.05550 120.0
[M+HCOO]- 188.05644 148.8
[M+CH3COO]- 202.07209 169.4
[M+Na-2H]- 164.03291 132.8
[M]+ 143.05769 129.0
[M]- 143.05879 129.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.