CID 118197

2-chlorotetradecane

Structural Information

Molecular Formula
C14H29Cl
SMILES
CCCCCCCCCCCCC(C)Cl
InChI
InChI=1S/C14H29Cl/c1-3-4-5-6-7-8-9-10-11-12-13-14(2)15/h14H,3-13H2,1-2H3
InChIKey
BDOUIUPFTBUPNU-UHFFFAOYSA-N
Compound name
2-chlorotetradecane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

59
Patents

232.19579 Da
Monoisotopic Mass

7.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 233.20307 161.8
[M+Na]+ 255.18501 166.3
[M-H]- 231.18851 160.6
[M+NH4]+ 250.22961 180.9
[M+K]+ 271.15895 162.2
[M+H-H2O]+ 215.19305 157.0
[M+HCOO]- 277.19399 177.4
[M+CH3COO]- 291.20964 196.2
[M+Na-2H]- 253.17046 162.9
[M]+ 232.19524 167.2
[M]- 232.19634 167.2
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.