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]+ 175.07536 135.2
[M+Na]+ 197.05730 142.1
[M-H]- 173.06080 142.5
[M+NH4]+ 192.10190 155.4
[M+K]+ 213.03124 141.3
[M+H-H2O]+ 157.06534 129.2
[M+HCOO]- 219.06628 158.7
[M+CH3COO]- 233.08193 177.3
[M+Na-2H]- 195.04275 141.1
[M]+ 174.06753 134.7
[M]- 174.06863 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.