CID 16212721

Ethyl (s)-3-(tert-butyldimethylsiloxy)glutarate

Structural Information

Molecular Formula
C13H26O5Si
SMILES
CCOC(=O)C[C@H](CC(=O)O)O[Si](C)(C)C(C)(C)C
InChI
InChI=1S/C13H26O5Si/c1-7-17-12(16)9-10(8-11(14)15)18-19(5,6)13(2,3)4/h10H,7-9H2,1-6H3,(H,14,15)/t10-/m0/s1
InChIKey
DUMCZOGDSYDSBG-JTQLQIEISA-N
Compound name
(3S)-3-[tert-butyl(dimethyl)silyl]oxy-5-ethoxy-5-oxopentanoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

290.15494 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 291.16222 167.0
[M+Na]+ 313.14416 171.2
[M-H]- 289.14766 165.2
[M+NH4]+ 308.18876 182.6
[M+K]+ 329.11810 171.8
[M+H-H2O]+ 273.15220 162.5
[M+HCOO]- 335.15314 182.2
[M+CH3COO]- 349.16879 198.9
[M+Na-2H]- 311.12961 167.9
[M]+ 290.15439 172.3
[M]- 290.15549 172.3
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.