CID 394536

Nsc698081

Structural Information

Molecular Formula
C15H26O4Si
SMILES
CCOC1=C(C(C1=O)(CC(=C)C)O[Si](C)(C)C)OCC
InChI
InChI=1S/C15H26O4Si/c1-8-17-12-13(16)15(10-11(3)4,14(12)18-9-2)19-20(5,6)7/h3,8-10H2,1-2,4-7H3
InChIKey
NPXKTDFAPVSBIK-UHFFFAOYSA-N
Compound name
2,3-diethoxy-4-(2-methylprop-2-enyl)-4-trimethylsilyloxycyclobut-2-en-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

298.16003 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 299.16731 168.8
[M+Na]+ 321.14925 174.8
[M-H]- 297.15275 172.3
[M+NH4]+ 316.19385 180.8
[M+K]+ 337.12319 176.8
[M+H-H2O]+ 281.15729 159.6
[M+HCOO]- 343.15823 187.5
[M+CH3COO]- 357.17388 208.1
[M+Na-2H]- 319.13470 170.2
[M]+ 298.15948 185.3
[M]- 298.16058 185.3
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.