CID 14302192

Methyl 3-methoxy-2,2-dimethylpropanoate

Structural Information

Molecular Formula
C7H14O3
SMILES
CC(C)(COC)C(=O)OC
InChI
InChI=1S/C7H14O3/c1-7(2,5-9-3)6(8)10-4/h5H2,1-4H3
InChIKey
WVPVQVXXTIVHIY-UHFFFAOYSA-N
Compound name
methyl 3-methoxy-2,2-dimethylpropanoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

186
Patents

146.0943 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 147.101576 130.5
[M+Na]+ 169.083518 138.0
[M-H]- 145.087024 131.2
[M+NH4]+ 164.128123 152.3
[M+K]+ 185.057458 139.3
[M+H-H2O]+ 129.091560 126.6
[M+HCOO]- 191.092501 152.5
[M+CH3COO]- 205.108151 175.7
[M+Na-2H]- 167.068966 136.8
[M]+ 146.09375142 134.8
[M]- 146.09484858 134.8
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