CID 14170676

3-benzoyl-2,5-dihydrofuran

Structural Information

Molecular Formula
C11H10O2
SMILES
C1C=C(CO1)C(=O)C2=CC=CC=C2
InChI
InChI=1S/C11H10O2/c12-11(10-6-7-13-8-10)9-4-2-1-3-5-9/h1-6H,7-8H2
InChIKey
HFVFVLPKGRVCON-UHFFFAOYSA-N
Compound name
2,5-dihydrofuran-3-yl(phenyl)methanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

174.06808 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 175.075356 135.2
[M+Na]+ 197.057298 142.1
[M-H]- 173.060804 142.5
[M+NH4]+ 192.101903 155.4
[M+K]+ 213.031238 141.3
[M+H-H2O]+ 157.065340 129.2
[M+HCOO]- 219.066281 158.7
[M+CH3COO]- 233.081931 177.3
[M+Na-2H]- 195.042746 141.1
[M]+ 174.06753142 134.7
[M]- 174.06862858 134.7
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.