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

2
Patents

143.09464 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 144.10192 126.7
[M+Na]+ 166.08386 135.7
[M-H]- 142.08736 129.9
[M+NH4]+ 161.12846 149.7
[M+K]+ 182.05780 136.9
[M+H-H2O]+ 126.09190 121.9
[M+HCOO]- 188.09284 149.5
[M+CH3COO]- 202.10849 173.0
[M+Na-2H]- 164.06931 134.2
[M]+ 143.09409 129.8
[M]- 143.09519 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