CID 643787

Nsc634857

Structural Information

Molecular Formula

C₁₄H₂₄

SMILES

C1CC/C=C\CCCCC/C=C\CC1

InChI

InChI=1S/C14H24/c1-2-4-6-8-10-12-14-13-11-9-7-5-3-1/h1-2,13-14H,3-12H2/b2-1-,14-13-

InChIKey

WCMISCDQOHKOAN-JOHUQSCISA-N

Compound name

(1Z,8Z)-cyclotetradeca-1,8-diene

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 33
Patents: 192.1878 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]+	193.19508	144.9
[M+Na]+	215.17702	146.5
[M-H]-	191.18052	145.3
[M+NH4]+	210.22162	160.8
[M+K]+	231.15096	145.4
[M+H-H2O]+	175.18506	141.8
[M+HCOO]-	237.18600	162.8
[M+CH3COO]-	251.20165	176.1
[M+Na-2H]-	213.16247	148.4
[M]+	192.18725	134.0
[M]-	192.18835	134.0

Literature stripe

literature stripe

Patent stripe

patents stripe