CID 24832091

Ethyl cellulose

Structural Information

Molecular Formula
C20H38O11
SMILES
CCOCC1C(C(C(C(O1)OC)OCC)OCC)OC2C(C(C(C(O2)CO)OC)O)O
InChI
InChI=1S/C20H38O11/c1-6-26-10-12-16(17(27-7-2)18(28-8-3)20(25-5)30-12)31-19-14(23)13(22)15(24-4)11(9-21)29-19/h11-23H,6-10H2,1-5H3
InChIKey
ZZSNKZQZMQGXPY-UHFFFAOYSA-N
Compound name
2-[4,5-diethoxy-2-(ethoxymethyl)-6-methoxyoxan-3-yl]oxy-6-(hydroxymethyl)-5-methoxyoxane-3,4-diol
Related CIDs

2D Structure

compound 2d structure
8
Annotation Hits

1101
References

48307
Patents

454.24142 Da
Monoisotopic Mass

-1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 455.24870 204.8
[M+Na]+ 477.23064 206.9
[M-H]- 453.23414 207.5
[M+NH4]+ 472.27524 209.3
[M+K]+ 493.20458 210.0
[M+H-H2O]+ 437.23868 196.6
[M+HCOO]- 499.23962 213.8
[M+CH3COO]- 513.25527 230.6
[M+Na-2H]- 475.21609 201.0
[M]+ 454.24087 212.8
[M]- 454.24197 212.8
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