CID 23263315

2-chloro-3,3-diethoxyprop-1-ene

Structural Information

Molecular Formula
C7H13ClO2
SMILES
CCOC(C(=C)Cl)OCC
InChI
InChI=1S/C7H13ClO2/c1-4-9-7(6(3)8)10-5-2/h7H,3-5H2,1-2H3
InChIKey
DDHSHXNOKGEBMS-UHFFFAOYSA-N
Compound name
2-chloro-3,3-diethoxyprop-1-ene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

164.06041 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 165.06769 132.8
[M+Na]+ 187.04963 143.4
[M+NH4]+ 182.09423 140.6
[M+K]+ 203.02357 138.0
[M-H]- 163.05313 131.7
[M+Na-2H]- 185.03508 136.1
[M]+ 164.05986 134.0
[M]- 164.06096 134.0
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.