CID 6450414

1,1,3-triethoxy-4-nonene

Structural Information

Molecular Formula
C15H30O3
SMILES
CCCC/C=C/[C@@H](CC(OCC)OCC)OCC
InChI
InChI=1S/C15H30O3/c1-5-9-10-11-12-14(16-6-2)13-15(17-7-3)18-8-4/h11-12,14-15H,5-10,13H2,1-4H3/b12-11+/t14-/m0/s1
InChIKey
GMJRSWGCHBIIBV-GETOMWPZSA-N
Compound name
(E,3R)-1,1,3-triethoxynon-4-ene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

258.21948 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 259.22676 166.5
[M+Na]+ 281.20870 174.2
[M+NH4]+ 276.25330 172.1
[M+K]+ 297.18264 168.2
[M-H]- 257.21220 164.5
[M+Na-2H]- 279.19415 167.1
[M]+ 258.21893 166.7
[M]- 258.22003 166.7
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.