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]+ 179.08553 162.8
[M+Na]+ 201.06747 168.5
[M-H]- 177.07097 166.5
[M+NH4]+ 196.11207 167.3
[M+K]+ 217.04141 165.3
[M+H-H2O]+ 161.07551 155.6
[M+HCOO]- 223.07645 163.3
[M+CH3COO]- 237.09210 242.1
[M+Na-2H]- 199.05292 160.2
[M]+ 178.07770 157.8
[M]- 178.07880 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.