CID 496553

Nsc693421

Structural Information

Molecular Formula
C22H32O4Si
SMILES
COC1(CCC2C1CC(C3C2C4=CC=CC=C4O3)(C(=C)[Si](C)(C)C)O)OC
InChI
InChI=1S/C22H32O4Si/c1-14(27(4,5)6)21(23)13-17-15(11-12-22(17,24-2)25-3)19-16-9-7-8-10-18(16)26-20(19)21/h7-10,15,17,19-20,23H,1,11-13H2,2-6H3
InChIKey
DPDZZWZMFZQENG-UHFFFAOYSA-N
Compound name
3,3-dimethoxy-5-(1-trimethylsilylethenyl)-2,3a,4,5a,10b,10c-hexahydro-1H-indeno[5,4-b][1]benzofuran-5-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

388.207 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 389.21428 194.4
[M+Na]+ 411.19622 200.8
[M-H]- 387.19972 199.0
[M+NH4]+ 406.24082 215.3
[M+K]+ 427.17016 197.3
[M+H-H2O]+ 371.20426 190.7
[M+HCOO]- 433.20520 204.7
[M+CH3COO]- 447.22085 217.9
[M+Na-2H]- 409.18167 195.3
[M]+ 388.20645 196.2
[M]- 388.20755 196.2
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.