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]+ 143.10666 127.5
[M+Na]+ 165.08860 135.2
[M-H]- 141.09210 132.0
[M+NH4]+ 160.13320 146.9
[M+K]+ 181.06254 137.9
[M+H-H2O]+ 125.09664 120.7
[M+HCOO]- 187.09758 149.7
[M+CH3COO]- 201.11323 178.3
[M+Na-2H]- 163.07405 135.1
[M]+ 142.09883 138.6
[M]- 142.09993 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.