CID 15061418

1,18-nonadecadiene

Structural Information

Molecular Formula
C19H36
SMILES
C=CCCCCCCCCCCCCCCCC=C
InChI
InChI=1S/C19H36/c1-3-5-7-9-11-13-15-17-19-18-16-14-12-10-8-6-4-2/h3-4H,1-2,5-19H2
InChIKey
ZICBMHDDLLEGHU-UHFFFAOYSA-N
Compound name
nonadeca-1,18-diene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

132
Patents

264.2817 Da
Monoisotopic Mass

9.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 265.28898 174.3
[M+Na]+ 287.27092 176.8
[M-H]- 263.27442 172.3
[M+NH4]+ 282.31552 191.2
[M+K]+ 303.24486 172.0
[M+H-H2O]+ 247.27896 167.8
[M+HCOO]- 309.27990 194.2
[M+CH3COO]- 323.29555 205.0
[M+Na-2H]- 285.25637 174.6
[M]+ 264.28115 179.2
[M]- 264.28225 179.2
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

patents stripe