CID 42607873

5-methoxy-7-prenyloxy-8-c-prenylflavanone

Structural Information

Molecular Formula
C26H30O4
SMILES
CC(=CCC1=C2C(=C(C=C1OCC=C(C)C)OC)C(=O)CC(O2)C3=CC=CC=C3)C
InChI
InChI=1S/C26H30O4/c1-17(2)11-12-20-23(29-14-13-18(3)4)16-24(28-5)25-21(27)15-22(30-26(20)25)19-9-7-6-8-10-19/h6-11,13,16,22H,12,14-15H2,1-5H3
InChIKey
KSYDDINMVMFLLB-UHFFFAOYSA-N
Compound name
5-methoxy-7-(3-methylbut-2-enoxy)-8-(3-methylbut-2-enyl)-2-phenyl-2,3-dihydrochromen-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

406.21442 Da
Monoisotopic Mass

6.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 407.22170 202.0
[M+Na]+ 429.20364 207.3
[M-H]- 405.20714 209.2
[M+NH4]+ 424.24824 212.5
[M+K]+ 445.17758 203.5
[M+H-H2O]+ 389.21168 192.8
[M+HCOO]- 451.21262 217.3
[M+CH3COO]- 465.22827 228.7
[M+Na-2H]- 427.18909 199.7
[M]+ 406.21387 205.7
[M]- 406.21497 205.7
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.