CID 11143640

6-lauroyl ethyl glucoside

Structural Information

Molecular Formula
C20H38O7
SMILES
CCCCCCCCCCCC(=O)OC[C@@H]1[C@H]([C@@H]([C@H](C(O1)OCC)O)O)O
InChI
InChI=1S/C20H38O7/c1-3-5-6-7-8-9-10-11-12-13-16(21)26-14-15-17(22)18(23)19(24)20(27-15)25-4-2/h15,17-20,22-24H,3-14H2,1-2H3/t15-,17-,18+,19-,20?/m1/s1
InChIKey
WEZXKKHKDWFRHC-FIBJEGPVSA-N
Compound name
[(2R,3S,4S,5R)-6-ethoxy-3,4,5-trihydroxyoxan-2-yl]methyl dodecanoate
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

19
Patents

390.26175 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 391.26903 197.6
[M+Na]+ 413.25097 199.0
[M-H]- 389.25447 195.7
[M+NH4]+ 408.29557 206.0
[M+K]+ 429.22491 197.6
[M+H-H2O]+ 373.25901 190.3
[M+HCOO]- 435.25995 209.2
[M+CH3COO]- 449.27560 217.1
[M+Na-2H]- 411.23642 193.3
[M]+ 390.26120 202.6
[M]- 390.26230 202.6
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

patents stripe