CID 137951916

2169461-43-0

Structural Information

Molecular Formula
C11H18O4
SMILES
CC(C)(C)OC1CC(=O)C1CC(=O)OC
InChI
InChI=1S/C11H18O4/c1-11(2,3)15-9-6-8(12)7(9)5-10(13)14-4/h7,9H,5-6H2,1-4H3
InChIKey
MFZVZUCYJXGXED-UHFFFAOYSA-N
Compound name
methyl 2-[2-[(2-methylpropan-2-yl)oxy]-4-oxocyclobutyl]acetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

214.12051 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 215.12779 150.6
[M+Na]+ 237.10973 155.1
[M+NH4]+ 232.15433 152.7
[M+K]+ 253.08367 153.5
[M-H]- 213.11323 146.6
[M+Na-2H]- 235.09518 150.1
[M]+ 214.11996 148.7
[M]- 214.12106 148.7
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

No patent data available for this compound.