CID 88541710

N-cyclobutyl-n-methylcarbamoyl chloride

Structural Information

Molecular Formula
C6H10ClNO
SMILES
CN(C1CCC1)C(=O)Cl
InChI
InChI=1S/C6H10ClNO/c1-8(6(7)9)5-3-2-4-5/h5H,2-4H2,1H3
InChIKey
XEGKZCVQLPQMTK-UHFFFAOYSA-N
Compound name
N-cyclobutyl-N-methylcarbamoyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

20
Patents

147.04509 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 148.052366 126.4
[M+Na]+ 170.034308 132.2
[M-H]- 146.037814 131.1
[M+NH4]+ 165.078913 142.4
[M+K]+ 186.008248 134.4
[M+H-H2O]+ 130.042350 116.9
[M+HCOO]- 192.043291 145.1
[M+CH3COO]- 206.058941 182.0
[M+Na-2H]- 168.019756 131.2
[M]+ 147.04454142 135.7
[M]- 147.04563858 135.7
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