CID 8183

1-dodecene

Structural Information

Molecular Formula
C12H24
SMILES
CCCCCCCCCCC=C
InChI
InChI=1S/C12H24/c1-3-5-7-9-11-12-10-8-6-4-2/h3H,1,4-12H2,2H3
InChIKey
CRSBERNSMYQZNG-UHFFFAOYSA-N
Compound name
dodec-1-ene
Related CIDs

2D Structure

compound 2d structure
7
Annotation Hits

484
References

143690
Patents

168.1878 Da
Monoisotopic Mass

6.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 169.19508 144.4
[M+Na]+ 191.17702 149.5
[M-H]- 167.18052 143.7
[M+NH4]+ 186.22162 165.3
[M+K]+ 207.15096 147.2
[M+H-H2O]+ 151.18506 139.3
[M+HCOO]- 213.18600 166.5
[M+CH3COO]- 227.20165 184.8
[M+Na-2H]- 189.16247 148.5
[M]+ 168.18725 147.3
[M]- 168.18835 147.3
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