CID 165352124

Dtxsid901178728

Structural Information

Molecular Formula
C19H39ClO2
SMILES
CCCCCCCCCCCCCCCOCCOCCCl
InChI
InChI=1S/C19H39ClO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-16-21-18-19-22-17-15-20/h2-19H2,1H3
InChIKey
DBUFQVSPMOQCCA-UHFFFAOYSA-N
Compound name
1-[2-(2-chloroethoxy)ethoxy]pentadecane
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

334.26385 Da
Monoisotopic Mass

7.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 335.27113 189.4
[M+Na]+ 357.25307 192.1
[M-H]- 333.25657 187.1
[M+NH4]+ 352.29767 204.4
[M+K]+ 373.22701 187.1
[M+H-H2O]+ 317.26111 183.0
[M+HCOO]- 379.26205 204.9
[M+CH3COO]- 393.27770 213.8
[M+Na-2H]- 355.23852 189.1
[M]+ 334.26330 200.4
[M]- 334.26440 200.4
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.