CID 5387614

Ferprenin

Structural Information

Molecular Formula
C24H28O3
SMILES
CC(=CCC/C(=C/CCC1(C=CC2=C(O1)C3=CC=CC=C3OC2=O)C)/C)C
InChI
InChI=1S/C24H28O3/c1-17(2)9-7-10-18(3)11-8-15-24(4)16-14-20-22(27-24)19-12-5-6-13-21(19)26-23(20)25/h5-6,9,11-14,16H,7-8,10,15H2,1-4H3/b18-11+
InChIKey
JQLNFODDCYXPCO-WOJGMQOQSA-N
Compound name
2-[(3E)-4,8-dimethylnona-3,7-dienyl]-2-methylpyrano[3,2-c]chromen-5-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

4
Patents

364.20386 Da
Monoisotopic Mass

6.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 365.21114 191.5
[M+Na]+ 387.19308 198.4
[M-H]- 363.19658 197.3
[M+NH4]+ 382.23768 205.6
[M+K]+ 403.16702 195.0
[M+H-H2O]+ 347.20112 183.5
[M+HCOO]- 409.20206 206.2
[M+CH3COO]- 423.21771 219.4
[M+Na-2H]- 385.17853 194.8
[M]+ 364.20331 196.0
[M]- 364.20441 196.0
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.