CID 13115534

5-cyclopropylfuran-2-carbaldehyde

Structural Information

Molecular Formula
C8H8O2
SMILES
C1CC1C2=CC=C(O2)C=O
InChI
InChI=1S/C8H8O2/c9-5-7-3-4-8(10-7)6-1-2-6/h3-6H,1-2H2
InChIKey
VAHANEOIBJTEFX-UHFFFAOYSA-N
Compound name
5-cyclopropylfuran-2-carbaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

9
Patents

136.05243 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 137.05971 128.3
[M+Na]+ 159.04165 141.9
[M+NH4]+ 154.08625 137.9
[M+K]+ 175.01559 139.2
[M-H]- 135.04515 139.1
[M+Na-2H]- 157.02710 137.3
[M]+ 136.05188 134.4
[M]- 136.05298 134.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe