CID 15759424

Chloromethyl n,n-dimethylcarbamate

Structural Information

Molecular Formula
C4H8ClNO2
SMILES
CN(C)C(=O)OCCl
InChI
InChI=1S/C4H8ClNO2/c1-6(2)4(7)8-3-5/h3H2,1-2H3
InChIKey
ODDBDWWPSOCNIB-UHFFFAOYSA-N
Compound name
chloromethyl N,N-dimethylcarbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

135
Patents

137.02435 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 138.03163 123.6
[M+Na]+ 160.01357 134.1
[M+NH4]+ 155.05817 131.8
[M+K]+ 175.98751 129.5
[M-H]- 136.01707 123.4
[M+Na-2H]- 157.99902 128.0
[M]+ 137.02380 125.0
[M]- 137.02490 125.0
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

patents stripe