CID 13506641

1-chloroethyl methyl carbonate

Structural Information

Molecular Formula
C4H7ClO3
SMILES
CC(OC(=O)OC)Cl
InChI
InChI=1S/C4H7ClO3/c1-3(5)8-4(6)7-2/h3H,1-2H3
InChIKey
CERXDWLUWLFFEK-UHFFFAOYSA-N
Compound name
1-chloroethyl methyl carbonate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

299
Patents

138.00838 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 139.01566 122.3
[M+Na]+ 160.99760 133.1
[M+NH4]+ 156.04220 130.1
[M+K]+ 176.97154 129.0
[M-H]- 137.00110 120.9
[M+Na-2H]- 158.98305 126.0
[M]+ 138.00783 123.4
[M]- 138.00893 123.4
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

patents stripe