CID 6367183

Silane, dimethyl((4-(4-propyl-2,6,7-trioxabicyclo(2.2.2)oct-1-yl)phenyl)ethynyl)-

Structural Information

Molecular Formula
C18H23O3Si
SMILES
CCCC12COC(OC1)(OC2)C3=CC=C(C=C3)C#C[Si](C)C
InChI
InChI=1S/C18H23O3Si/c1-4-10-17-12-19-18(20-13-17,21-14-17)16-7-5-15(6-8-16)9-11-22(2)3/h5-8H,4,10,12-14H2,1-3H3
InChIKey
FIUQEYWDTLKGPT-UHFFFAOYSA-N
Compound name
None
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

315.14163 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 316.14891 170.2
[M+Na]+ 338.13085 179.3
[M-H]- 314.13435 170.5
[M+NH4]+ 333.17545 187.7
[M+K]+ 354.10479 171.7
[M+H-H2O]+ 298.13889 157.5
[M+HCOO]- 360.13983 173.7
[M+CH3COO]- 374.15548 178.4
[M+Na-2H]- 336.11630 179.7
[M]+ 315.14108 169.9
[M]- 315.14218 169.9
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.