CID 554377

Ethane, 1,1'-oxybis[2,2-dimethoxy-

Structural Information

Molecular Formula
C8H18O5
SMILES
COC(COCC(OC)OC)OC
InChI
InChI=1S/C8H18O5/c1-9-7(10-2)5-13-6-8(11-3)12-4/h7-8H,5-6H2,1-4H3
InChIKey
ZOJJJVRLKLQJNV-UHFFFAOYSA-N
Compound name
2-(2,2-dimethoxyethoxy)-1,1-dimethoxyethane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

501
Patents

194.11542 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 195.12270 142.8
[M+Na]+ 217.10464 148.6
[M-H]- 193.10814 142.8
[M+NH4]+ 212.14924 162.3
[M+K]+ 233.07858 151.3
[M+H-H2O]+ 177.11268 137.3
[M+HCOO]- 239.11362 165.2
[M+CH3COO]- 253.12927 184.9
[M+Na-2H]- 215.09009 146.5
[M]+ 194.11487 151.0
[M]- 194.11597 151.0
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

patents stripe