CID 56935982

(z)-5-dodecenyl (z)-5-dodecenoate

Structural Information

Molecular Formula
C24H44O2
SMILES
CCCCCC/C=C\CCCCOC(=O)CCC/C=C\CCCCCC
InChI
InChI=1S/C24H44O2/c1-3-5-7-9-11-13-15-17-19-21-23-26-24(25)22-20-18-16-14-12-10-8-6-4-2/h13-16H,3-12,17-23H2,1-2H3/b15-13-,16-14-
InChIKey
QDYCXCCNDHIUHQ-VMNXYWKNSA-N
Compound name
[(Z)-dodec-5-enyl] (Z)-dodec-5-enoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

364.33414 Da
Monoisotopic Mass

9.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 365.34142 202.8
[M+Na]+ 387.32336 203.4
[M-H]- 363.32686 199.9
[M+NH4]+ 382.36796 215.6
[M+K]+ 403.29730 198.1
[M+H-H2O]+ 347.33140 195.1
[M+HCOO]- 409.33234 220.8
[M+CH3COO]- 423.34799 221.3
[M+Na-2H]- 385.30881 199.1
[M]+ 364.33359 210.9
[M]- 364.33469 210.9
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.