CID 5283355

2-decene-4,6,8-triyn-1-al

Structural Information

Molecular Formula
C10H6O
SMILES
CC#CC#CC#C/C=C/C=O
InChI
InChI=1S/C10H6O/c1-2-3-4-5-6-7-8-9-10-11/h8-10H,1H3/b9-8+
InChIKey
VUDTWAKUCKMKKY-CMDGGOBGSA-N
Compound name
(E)-dec-2-en-4,6,8-triynal
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

142.04187 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 143.04915 157.8
[M+Na]+ 165.03109 166.3
[M-H]- 141.03459 160.8
[M+NH4]+ 160.07569 166.7
[M+K]+ 181.00503 162.6
[M+H-H2O]+ 125.03913 146.6
[M+HCOO]- 187.04007 161.7
[M+CH3COO]- 201.05572 224.9
[M+Na-2H]- 163.01654 157.1
[M]+ 142.04132 150.5
[M]- 142.04242 150.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.