CID 3032654

1,2-diethoxyethylene

Structural Information

Molecular Formula
C6H12O2
SMILES
CCO/C=C/OCC
InChI
InChI=1S/C6H12O2/c1-3-7-5-6-8-4-2/h5-6H,3-4H2,1-2H3/b6-5+
InChIKey
HDUOBOAWDSZFTJ-AATRIKPKSA-N
Compound name
(E)-1,2-diethoxyethene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

57
Patents

116.08373 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 117.09101 123.2
[M+Na]+ 139.07295 130.8
[M-H]- 115.07645 123.6
[M+NH4]+ 134.11755 146.1
[M+K]+ 155.04689 131.1
[M+H-H2O]+ 99.080990 118.9
[M+HCOO]- 161.08193 147.8
[M+CH3COO]- 175.09758 169.6
[M+Na-2H]- 137.05840 130.5
[M]+ 116.08318 126.7
[M]- 116.08428 126.7
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.