CID 5356954

Cis-6-tridecene

Structural Information

Molecular Formula

C₁₃H₂₆

SMILES

CCCCCC/C=C\CCCCC

InChI

InChI=1S/C13H26/c1-3-5-7-9-11-13-12-10-8-6-4-2/h11,13H,3-10,12H2,1-2H3/b13-11-

InChIKey

QHOMPCGOCNNMFK-QBFSEMIESA-N

Compound name

(Z)-tridec-6-ene

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 94
Patents: 182.20345 Da
Monoisotopic Mass: 6.3
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]+	183.210726	149.2
[M+Na]+	205.192668	153.9
[M-H]-	181.196174	148.4
[M+NH4]+	200.237273	169.6
[M+K]+	221.166608	151.4
[M+H-H2O]+	165.200710	143.9
[M+HCOO]-	227.201651	170.9
[M+CH3COO]-	241.217301	187.1
[M+Na-2H]-	203.178116	152.7
[M]+	182.20290142	152.4
[M]-	182.20399858	152.4

Literature stripe

literature stripe

Patent stripe

patents stripe