CID 130672500

1-methoxy-3,3-dimethylcyclobutane-1-carbaldehyde

Structural Information

Molecular Formula
C8H14O2
SMILES
CC1(CC(C1)(C=O)OC)C
InChI
InChI=1S/C8H14O2/c1-7(2)4-8(5-7,6-9)10-3/h6H,4-5H2,1-3H3
InChIKey
HYZOOGINTKVLEO-UHFFFAOYSA-N
Compound name
1-methoxy-3,3-dimethylcyclobutane-1-carbaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

142.09938 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 143.106656 127.5
[M+Na]+ 165.088598 135.2
[M-H]- 141.092104 132.0
[M+NH4]+ 160.133203 146.9
[M+K]+ 181.062538 137.9
[M+H-H2O]+ 125.096640 120.7
[M+HCOO]- 187.097581 149.7
[M+CH3COO]- 201.113231 178.3
[M+Na-2H]- 163.074046 135.1
[M]+ 142.09883142 138.6
[M]- 142.09992858 138.6
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.