CID 5365091

Ethyl propenyl ether

Structural Information

Molecular Formula
C5H10O
SMILES
CCO/C=C/C
InChI
InChI=1S/C5H10O/c1-3-5-6-4-2/h3,5H,4H2,1-2H3/b5-3+
InChIKey
XDHOEHJVXXTEDV-HWKANZROSA-N
Compound name
(E)-1-ethoxyprop-1-ene
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

1389
Patents

86.073166 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 87.080442 115.4
[M+Na]+ 109.06238 123.5
[M-H]- 85.065890 116.0
[M+NH4]+ 104.10699 139.6
[M+K]+ 125.03632 123.6
[M+H-H2O]+ 69.070426 111.5
[M+HCOO]- 131.07137 140.0
[M+CH3COO]- 145.08702 164.7
[M+Na-2H]- 107.04783 123.3
[M]+ 86.072617 117.1
[M]- 86.073715 117.1
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