CID 131751387

2,12-tetradecadiene-4,6,8,10-tetrayne

Structural Information

Molecular Formula
C14H10
SMILES
C/C=C\C#CC#CC#CC#C/C=C\C
InChI
InChI=1S/C14H10/c1-3-5-7-9-11-13-14-12-10-8-6-4-2/h3-6H,1-2H3/b5-3-,6-4-
InChIKey
WNKUNTYSRYMVDG-GLIMQPGKSA-N
Compound name
(2Z,12Z)-tetradeca-2,12-dien-4,6,8,10-tetrayne
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

178.07825 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 179.085526 162.8
[M+Na]+ 201.067468 168.5
[M-H]- 177.070974 166.5
[M+NH4]+ 196.112073 167.3
[M+K]+ 217.041408 165.3
[M+H-H2O]+ 161.075510 155.6
[M+HCOO]- 223.076451 163.3
[M+CH3COO]- 237.092101 242.1
[M+Na-2H]- 199.052916 160.2
[M]+ 178.07770142 157.8
[M]- 178.07879858 157.8
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.