CID 6450368

(z)-13-chloro-5-tridecene

Structural Information

Molecular Formula

C₁₃H₂₅Cl

SMILES

CCCC/C=C/CCCCCCCCl

InChI

InChI=1S/C13H25Cl/c1-2-3-4-5-6-7-8-9-10-11-12-13-14/h5-6H,2-4,7-13H2,1H3/b6-5+

InChIKey

IKVOAYSYYWFSDI-AATRIKPKSA-N

Compound name

(E)-13-chlorotridec-5-ene

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 216.16447 Da
Monoisotopic Mass: 6.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	217.17175	155.4
[M+Na]+	239.15369	160.9
[M-H]-	215.15719	154.3
[M+NH4]+	234.19829	175.2
[M+K]+	255.12763	156.1
[M+H-H2O]+	199.16173	150.8
[M+HCOO]-	261.16267	172.6
[M+CH3COO]-	275.17832	190.9
[M+Na-2H]-	237.13914	158.4
[M]+	216.16392	160.3
[M]-	216.16502	160.3

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.