CID 134690868

1-(oxan-2-yl)cyclobutane-1-carbaldehyde

Structural Information

Molecular Formula
C10H16O2
SMILES
C1CCOC(C1)C2(CCC2)C=O
InChI
InChI=1S/C10H16O2/c11-8-10(5-3-6-10)9-4-1-2-7-12-9/h8-9H,1-7H2
InChIKey
KUINUQYYAOFCER-UHFFFAOYSA-N
Compound name
1-(oxan-2-yl)cyclobutane-1-carbaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

168.11504 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 169.12232 130.8
[M+Na]+ 191.10426 134.5
[M-H]- 167.10776 137.2
[M+NH4]+ 186.14886 145.1
[M+K]+ 207.07820 137.7
[M+H-H2O]+ 151.11230 121.0
[M+HCOO]- 213.11324 149.0
[M+CH3COO]- 227.12889 179.9
[M+Na-2H]- 189.08971 137.7
[M]+ 168.11449 135.8
[M]- 168.11559 135.8
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

No patent data available for this compound.