CID 20667

Dodecyl ether

Structural Information

Molecular Formula
C24H50O
SMILES
CCCCCCCCCCCCOCCCCCCCCCCCC
InChI
InChI=1S/C24H50O/c1-3-5-7-9-11-13-15-17-19-21-23-25-24-22-20-18-16-14-12-10-8-6-4-2/h3-24H2,1-2H3
InChIKey
CMCBDXRRFKYBDG-UHFFFAOYSA-N
Compound name
1-dodecoxydodecane
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

164
References

77326
Patents

354.38617 Da
Monoisotopic Mass

11.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 355.39345 203.2
[M+Na]+ 377.37539 202.9
[M-H]- 353.37889 200.0
[M+NH4]+ 372.41999 216.5
[M+K]+ 393.34933 198.4
[M+H-H2O]+ 337.38343 195.3
[M+HCOO]- 399.38437 221.2
[M+CH3COO]- 413.40002 223.3
[M+Na-2H]- 375.36084 200.6
[M]+ 354.38562 212.8
[M]- 354.38672 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

No literature data available for this compound.

Patent stripe

No patent data available for this compound.