CID 20836276

(z)-1-(1-propoxyethoxy)hex-3-ene

Structural Information

Molecular Formula
C11H22O2
SMILES
CCCOC(C)OCC/C=C\CC
InChI
InChI=1S/C11H22O2/c1-4-6-7-8-10-13-11(3)12-9-5-2/h6-7,11H,4-5,8-10H2,1-3H3/b7-6-
InChIKey
XVCPIEQWTJKZIU-SREVYHEPSA-N
Compound name
(Z)-1-(1-propoxyethoxy)hex-3-ene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

186.16199 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 187.169266 147.1
[M+Na]+ 209.151208 152.4
[M-H]- 185.154714 146.6
[M+NH4]+ 204.195813 167.1
[M+K]+ 225.125148 151.7
[M+H-H2O]+ 169.159250 141.7
[M+HCOO]- 231.160191 169.0
[M+CH3COO]- 245.175841 185.5
[M+Na-2H]- 207.136656 150.3
[M]+ 186.16144142 151.8
[M]- 186.16253858 151.8
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

No patent data available for this compound.