CID 41310

5-propyltridecane

Structural Information

Molecular Formula
C16H34
SMILES
CCCCCCCCC(CCC)CCCC
InChI
InChI=1S/C16H34/c1-4-7-9-10-11-12-15-16(13-6-3)14-8-5-2/h16H,4-15H2,1-3H3
InChIKey
SCMYWAVVKSTDNI-UHFFFAOYSA-N
Compound name
5-propyltridecane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

51
Patents

226.26605 Da
Monoisotopic Mass

8.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 227.27333 162.7
[M+Na]+ 249.25527 172.0
[M+NH4]+ 244.29987 170.4
[M+K]+ 265.22921 163.4
[M-H]- 225.25877 162.9
[M+Na-2H]- 247.24072 165.0
[M]+ 226.26550 164.0
[M]- 226.26660 164.0
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