CID 6440707

1,3,6,9-nonadecatetraene, (3z,6z,9z)-

Structural Information

Molecular Formula
C19H32
SMILES
CCCCCCCCC/C=C\C/C=C\C/C=C\C=C
InChI
InChI=1S/C19H32/c1-3-5-7-9-11-13-15-17-19-18-16-14-12-10-8-6-4-2/h3,5,7,11,13,17,19H,1,4,6,8-10,12,14-16,18H2,2H3/b7-5-,13-11-,19-17-
InChIKey
RDRCFYBWAIFESA-JTBMWNAQSA-N
Compound name
(3Z,6Z,9Z)-nonadeca-1,3,6,9-tetraene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

41
Patents

260.2504 Da
Monoisotopic Mass

8.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 261.25768 171.4
[M+Na]+ 283.23962 174.7
[M-H]- 259.24312 169.6
[M+NH4]+ 278.28422 188.6
[M+K]+ 299.21356 168.8
[M+H-H2O]+ 243.24766 165.2
[M+HCOO]- 305.24860 191.8
[M+CH3COO]- 319.26425 201.2
[M+Na-2H]- 281.22507 171.8
[M]+ 260.24985 174.7
[M]- 260.25095 174.7
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.