CID 11579424

3-(diethoxymethyl)-2-ethoxyoxolane

Structural Information

Molecular Formula
C11H22O4
SMILES
CCOC1C(CCO1)C(OCC)OCC
InChI
InChI=1S/C11H22O4/c1-4-12-10(13-5-2)9-7-8-15-11(9)14-6-3/h9-11H,4-8H2,1-3H3
InChIKey
DNWIQYGZMJTBKC-UHFFFAOYSA-N
Compound name
3-(diethoxymethyl)-2-ethoxyoxolane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

72
Patents

218.15181 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 219.15909 151.6
[M+Na]+ 241.14103 156.5
[M-H]- 217.14453 154.9
[M+NH4]+ 236.18563 170.6
[M+K]+ 257.11497 158.1
[M+H-H2O]+ 201.14907 145.9
[M+HCOO]- 263.15001 172.2
[M+CH3COO]- 277.16566 188.2
[M+Na-2H]- 239.12648 153.7
[M]+ 218.15126 156.2
[M]- 218.15236 156.2
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

patents stripe