CID 12389

Tetradecane

Structural Information

Molecular Formula
C14H30
SMILES
CCCCCCCCCCCCCC
InChI
InChI=1S/C14H30/c1-3-5-7-9-11-13-14-12-10-8-6-4-2/h3-14H2,1-2H3
InChIKey
BGHCVCJVXZWKCC-UHFFFAOYSA-N
Compound name
tetradecane
Related CIDs

2D Structure

compound 2d structure
7
Annotation Hits

454
References

71005
Patents

198.23476 Da
Monoisotopic Mass

7.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 199.24204 153.3
[M+Na]+ 221.22398 163.4
[M+NH4]+ 216.26858 161.5
[M+K]+ 237.19792 154.5
[M-H]- 197.22748 153.8
[M+Na-2H]- 219.20943 156.6
[M]+ 198.23421 154.8
[M]- 198.23531 154.8
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