CID 16072886

2-indan-5-yl-3-methoxy-8,8-dimethyl-pyrano[2,3-f]chromen-4-one

Structural Information

Molecular Formula
C24H22O4
SMILES
CC1(C=CC2=C(O1)C=CC3=C2OC(=C(C3=O)OC)C4=CC5=C(CCC5)C=C4)C
InChI
InChI=1S/C24H22O4/c1-24(2)12-11-17-19(28-24)10-9-18-20(25)23(26-3)21(27-22(17)18)16-8-7-14-5-4-6-15(14)13-16/h7-13H,4-6H2,1-3H3
InChIKey
ACWNBDGDNYBZDJ-UHFFFAOYSA-N
Compound name
2-(2,3-dihydro-1H-inden-5-yl)-3-methoxy-8,8-dimethylpyrano[2,3-f]chromen-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

374.1518 Da
Monoisotopic Mass

5.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 375.15908 188.9
[M+Na]+ 397.14102 199.7
[M-H]- 373.14452 200.3
[M+NH4]+ 392.18562 205.4
[M+K]+ 413.11496 196.4
[M+H-H2O]+ 357.14906 180.4
[M+HCOO]- 419.15000 205.5
[M+CH3COO]- 433.16565 200.7
[M+Na-2H]- 395.12647 193.1
[M]+ 374.15125 194.0
[M]- 374.15235 194.0
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.