CID 12999

Decane, 1-(ethenyloxy)-

Structural Information

Molecular Formula
C12H24O
SMILES
CCCCCCCCCCOC=C
InChI
InChI=1S/C12H24O/c1-3-5-6-7-8-9-10-11-12-13-4-2/h4H,2-3,5-12H2,1H3
InChIKey
NSOAQRMLVFRWIT-UHFFFAOYSA-N
Compound name
1-ethenoxydecane
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

7135
Patents

184.18271 Da
Monoisotopic Mass

5.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 185.18999 147.7
[M+Na]+ 207.17193 152.8
[M-H]- 183.17543 147.0
[M+NH4]+ 202.21653 167.9
[M+K]+ 223.14587 151.0
[M+H-H2O]+ 167.17997 142.3
[M+HCOO]- 229.18091 170.0
[M+CH3COO]- 243.19656 186.6
[M+Na-2H]- 205.15738 151.7
[M]+ 184.18216 152.1
[M]- 184.18326 152.1
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.