CID 10290810

1-chloro-2-(chloromethoxy)ethane

Structural Information

Molecular Formula
C3H6Cl2O
SMILES
C(CCl)OCCl
InChI
InChI=1S/C3H6Cl2O/c4-1-2-6-3-5/h1-3H2
InChIKey
LUTWEKBTDWRTSE-UHFFFAOYSA-N
Compound name
1-chloro-2-(chloromethoxy)ethane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

506
Patents

127.97957 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 128.98685 118.7
[M+Na]+ 150.96879 128.2
[M-H]- 126.97229 118.6
[M+NH4]+ 146.01339 142.1
[M+K]+ 166.94273 125.4
[M+H-H2O]+ 110.97683 116.6
[M+HCOO]- 172.97777 134.0
[M+CH3COO]- 186.99342 169.3
[M+Na-2H]- 148.95424 126.3
[M]+ 127.97902 122.6
[M]- 127.98012 122.6
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

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