CID 759293

2-(prop-1-en-2-yl)-2h,3h,7h-furo[3,2-g]chromen-7-one

Structural Information

Molecular Formula
C14H12O3
SMILES
CC(=C)[C@@H]1CC2=C(O1)C=C3C(=C2)C=CC(=O)O3
InChI
InChI=1S/C14H12O3/c1-8(2)11-6-10-5-9-3-4-14(15)17-12(9)7-13(10)16-11/h3-5,7,11H,1,6H2,2H3/t11-/m0/s1
InChIKey
VMWUHWZFDITAOL-NSHDSACASA-N
Compound name
(2S)-2-prop-1-en-2-yl-2,3-dihydrofuro[3,2-g]chromen-7-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

0
Patents

228.07864 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 229.08592 146.8
[M+Na]+ 251.06786 157.0
[M-H]- 227.07136 154.2
[M+NH4]+ 246.11246 166.6
[M+K]+ 267.04180 155.5
[M+H-H2O]+ 211.07590 141.8
[M+HCOO]- 273.07684 166.9
[M+CH3COO]- 287.09249 161.0
[M+Na-2H]- 249.05331 153.2
[M]+ 228.07809 150.1
[M]- 228.07919 150.1
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

No patent data available for this compound.