CID 18629498

Chloromethyl 2-methoxyethyl carbonate

Structural Information

Molecular Formula
C5H9ClO4
SMILES
COCCOC(=O)OCCl
InChI
InChI=1S/C5H9ClO4/c1-8-2-3-9-5(7)10-4-6/h2-4H2,1H3
InChIKey
XIQFQYLHQIVRSP-UHFFFAOYSA-N
Compound name
chloromethyl 2-methoxyethyl carbonate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

88
Patents

168.01894 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 169.02622 129.2
[M+Na]+ 191.00816 137.8
[M-H]- 167.01166 129.7
[M+NH4]+ 186.05276 150.8
[M+K]+ 206.98210 137.4
[M+H-H2O]+ 151.01620 125.6
[M+HCOO]- 213.01714 149.1
[M+CH3COO]- 227.03279 174.6
[M+Na-2H]- 188.99361 135.4
[M]+ 168.01839 136.3
[M]- 168.01949 136.3
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