CID 6438017

5-hexadecene, 16,16-diethoxy-, (5z)-

Structural Information

Molecular Formula
C20H40O2
SMILES
CCCC/C=C\CCCCCCCCCC(OCC)OCC
InChI
InChI=1S/C20H40O2/c1-4-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21-5-2)22-6-3/h9-10,20H,4-8,11-19H2,1-3H3/b10-9-
InChIKey
JAOYXKSQTHADHX-KTKRTIGZSA-N
Compound name
(Z)-16,16-diethoxyhexadec-5-ene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

7
Patents

312.30283 Da
Monoisotopic Mass

7.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 313.31011 185.5
[M+Na]+ 335.29205 193.0
[M+NH4]+ 330.33665 191.0
[M+K]+ 351.26599 184.4
[M-H]- 311.29555 184.1
[M+Na-2H]- 333.27750 185.6
[M]+ 312.30228 185.8
[M]- 312.30338 185.8
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

patents stripe