CID 13848

1-chlorodecane

Structural Information

Molecular Formula
C10H21Cl
SMILES
CCCCCCCCCCCl
InChI
InChI=1S/C10H21Cl/c1-2-3-4-5-6-7-8-9-10-11/h2-10H2,1H3
InChIKey
ZTEHOZMYMCEYRM-UHFFFAOYSA-N
Compound name
1-chlorodecane
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

10
References

5313
Patents

176.13318 Da
Monoisotopic Mass

5.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 177.14046 142.9
[M+Na]+ 199.12240 149.2
[M-H]- 175.12590 142.2
[M+NH4]+ 194.16700 164.2
[M+K]+ 215.09634 145.8
[M+H-H2O]+ 159.13044 138.7
[M+HCOO]- 221.13138 160.8
[M+CH3COO]- 235.14703 183.5
[M+Na-2H]- 197.10785 147.4
[M]+ 176.13263 147.4
[M]- 176.13373 147.4
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