CID 9589284

N-(acetyloxy)butanimidoyl chloride

Structural Information

Molecular Formula
C6H10ClNO2
SMILES
CCC/C(=N/OC(=O)C)/Cl
InChI
InChI=1S/C6H10ClNO2/c1-3-4-6(7)8-10-5(2)9/h3-4H2,1-2H3/b8-6-
InChIKey
NRABTMVIESGWIO-VURMDHGXSA-N
Compound name
[(Z)-1-chlorobutylideneamino] acetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

163.04001 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 164.04729 131.8
[M+Na]+ 186.02923 141.9
[M+NH4]+ 181.07383 139.4
[M+K]+ 202.00317 136.8
[M-H]- 162.03273 131.3
[M+Na-2H]- 184.01468 135.5
[M]+ 163.03946 133.0
[M]- 163.04056 133.0
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

No patent data available for this compound.