CID 522441

(5z)-dodec-5-ene

Structural Information

Molecular Formula
C12H24
SMILES
CCCCCCC=CCCCC
InChI
InChI=1S/C12H24/c1-3-5-7-9-11-12-10-8-6-4-2/h9,11H,3-8,10,12H2,1-2H3
InChIKey
ZOKYTRIEIDWYSG-UHFFFAOYSA-N
Compound name
dodec-5-ene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1457
Patents

168.1878 Da
Monoisotopic Mass

5.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 169.19508 144.6
[M+Na]+ 191.17702 149.8
[M-H]- 167.18052 144.0
[M+NH4]+ 186.22162 165.6
[M+K]+ 207.15096 147.6
[M+H-H2O]+ 151.18506 139.5
[M+HCOO]- 213.18600 166.7
[M+CH3COO]- 227.20165 184.1
[M+Na-2H]- 189.16247 148.7
[M]+ 168.18725 147.5
[M]- 168.18835 147.5
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

patents stripe