CID 3041075

Oxazole, 4,5-dihydro-4,4-dimethyl-2-(methoxymethyl)-

Structural Information

Molecular Formula
C7H13NO2
SMILES
CC1(COC(=N1)COC)C
InChI
InChI=1S/C7H13NO2/c1-7(2)5-10-6(8-7)4-9-3/h4-5H2,1-3H3
InChIKey
ONMRSDGRLVKJMN-UHFFFAOYSA-N
Compound name
2-(methoxymethyl)-4,4-dimethyl-5H-1,3-oxazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

143.09464 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 144.101916 126.7
[M+Na]+ 166.083858 135.7
[M-H]- 142.087364 129.9
[M+NH4]+ 161.128463 149.7
[M+K]+ 182.057798 136.9
[M+H-H2O]+ 126.091900 121.9
[M+HCOO]- 188.092841 149.5
[M+CH3COO]- 202.108491 173.0
[M+Na-2H]- 164.069306 134.2
[M]+ 143.09409142 129.8
[M]- 143.09518858 129.8
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

patents stripe