CID 12566213

Methyl 2-methoxy-2-methylpropanoate

Structural Information

Molecular Formula
C6H12O3
SMILES
CC(C)(C(=O)OC)OC
InChI
InChI=1S/C6H12O3/c1-6(2,9-4)5(7)8-3/h1-4H3
InChIKey
AKWHOGIYEOZALP-UHFFFAOYSA-N
Compound name
methyl 2-methoxy-2-methylpropanoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6485
Patents

132.07864 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 133.08592 126.6
[M+Na]+ 155.06786 136.2
[M+NH4]+ 150.11246 133.7
[M+K]+ 171.04180 132.8
[M-H]- 131.07136 124.6
[M+Na-2H]- 153.05331 129.8
[M]+ 132.07809 127.2
[M]- 132.07919 127.2
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

patents stripe