CID 6449268

132828-22-9

Structural Information

Molecular Formula
C19H16O3
SMILES
COC1=CC2=C(C=C1)OC/C(=C/C=C/C3=CC=CC=C3)/C2=O
InChI
InChI=1S/C19H16O3/c1-21-16-10-11-18-17(12-16)19(20)15(13-22-18)9-5-8-14-6-3-2-4-7-14/h2-12H,13H2,1H3/b8-5+,15-9-
InChIKey
XEDXCCIPPOQHAP-OTLSHVCWSA-N
Compound name
(3Z)-6-methoxy-3-[(E)-3-phenylprop-2-enylidene]chromen-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

292.10995 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 293.117226 166.9
[M+Na]+ 315.099168 174.5
[M-H]- 291.102674 174.8
[M+NH4]+ 310.143773 182.0
[M+K]+ 331.073108 170.2
[M+H-H2O]+ 275.107210 158.7
[M+HCOO]- 337.108151 186.8
[M+CH3COO]- 351.123801 201.5
[M+Na-2H]- 313.084616 172.1
[M]+ 292.10940142 167.3
[M]- 292.11049858 167.3
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.