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
8
Annotation Hits

454
References

100067
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 155.3
[M+Na]+ 221.22398 159.2
[M-H]- 197.22748 154.1
[M+NH4]+ 216.26858 175.0
[M+K]+ 237.19792 157.0
[M+H-H2O]+ 181.23202 149.6
[M+HCOO]- 243.23296 176.5
[M+CH3COO]- 257.24861 191.7
[M+Na-2H]- 219.20943 158.2
[M]+ 198.23421 159.7
[M]- 198.23531 159.7
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