CID 131751410

Licarin c

Structural Information

Molecular Formula
C22H26O5
SMILES
C/C=C\C1=CC2=C(C(=C1)OC)OC(C2C)C3=CC(=C(C(=C3)OC)OC)OC
InChI
InChI=1S/C22H26O5/c1-7-8-14-9-16-13(2)20(27-21(16)17(10-14)23-3)15-11-18(24-4)22(26-6)19(12-15)25-5/h7-13,20H,1-6H3/b8-7-
InChIKey
GPTWTKZDAAYJRN-FPLPWBNLSA-N
Compound name
7-methoxy-3-methyl-5-[(Z)-prop-1-enyl]-2-(3,4,5-trimethoxyphenyl)-2,3-dihydro-1-benzofuran
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

370.178 Da
Monoisotopic Mass

4.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 371.18528 188.9
[M+Na]+ 393.16722 198.5
[M-H]- 369.17072 198.1
[M+NH4]+ 388.21182 203.8
[M+K]+ 409.14116 196.2
[M+H-H2O]+ 353.17526 181.7
[M+HCOO]- 415.17620 209.8
[M+CH3COO]- 429.19185 221.2
[M+Na-2H]- 391.15267 188.4
[M]+ 370.17745 198.7
[M]- 370.17855 198.7
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.