CID 10038373

136314-66-4

Structural Information

Molecular Formula
C15H22O2Si
SMILES
C/C=C/[C@H](CC(=O)OC)[Si](C)(C)C1=CC=CC=C1
InChI
InChI=1S/C15H22O2Si/c1-5-9-14(12-15(16)17-2)18(3,4)13-10-7-6-8-11-13/h5-11,14H,12H2,1-4H3/b9-5+/t14-/m1/s1
InChIKey
LCBVSVWXXPCVKB-VZUFXWRPSA-N
Compound name
methyl (E,3S)-3-[dimethyl(phenyl)silyl]hex-4-enoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

262.13892 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 263.146196 162.1
[M+Na]+ 285.128138 167.1
[M-H]- 261.131644 164.9
[M+NH4]+ 280.172743 179.4
[M+K]+ 301.102078 164.8
[M+H-H2O]+ 245.136180 155.8
[M+HCOO]- 307.137121 181.6
[M+CH3COO]- 321.152771 195.5
[M+Na-2H]- 283.113586 164.7
[M]+ 262.13837142 164.2
[M]- 262.13946858 164.2
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.