CID 18787449

2,3-dihydrobenzofuran-4-carbaldehyde

Structural Information

Molecular Formula
C9H8O2
SMILES
C1COC2=CC=CC(=C21)C=O
InChI
InChI=1S/C9H8O2/c10-6-7-2-1-3-9-8(7)4-5-11-9/h1-3,6H,4-5H2
InChIKey
MKWRRGVTYBMERJ-UHFFFAOYSA-N
Compound name
2,3-dihydro-1-benzofuran-4-carbaldehyde
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

69
Patents

148.05243 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 149.05971 127.1
[M+Na]+ 171.04165 140.1
[M+NH4]+ 166.08625 136.9
[M+K]+ 187.01559 135.4
[M-H]- 147.04515 130.7
[M+Na-2H]- 169.02710 132.9
[M]+ 148.05188 129.9
[M]- 148.05298 129.9
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