CID 46411

Mc 2666

Structural Information

Molecular Formula
C11H24O3
SMILES
CCC(CC)(CO)C(OCC)OCC
InChI
InChI=1S/C11H24O3/c1-5-11(6-2,9-12)10(13-7-3)14-8-4/h10,12H,5-9H2,1-4H3
InChIKey
GDEOUXOJGKXLRX-UHFFFAOYSA-N
Compound name
2-(diethoxymethyl)-2-ethylbutan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

204.17255 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 205.17983 149.6
[M+Na]+ 227.16177 157.6
[M+NH4]+ 222.20637 155.8
[M+K]+ 243.13571 153.5
[M-H]- 203.16527 147.2
[M+Na-2H]- 225.14722 151.1
[M]+ 204.17200 149.8
[M]- 204.17310 149.8
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.