CID 3307289

O-(n-(3,4-dichlorophenyl)carbamoyl)acetone oxime

Structural Information

Molecular Formula
C10H10Cl2N2O2
SMILES
CC(=NOC(=O)NC1=CC(=C(C=C1)Cl)Cl)C
InChI
InChI=1S/C10H10Cl2N2O2/c1-6(2)14-16-10(15)13-7-3-4-8(11)9(12)5-7/h3-5H,1-2H3,(H,13,15)
InChIKey
AUXSLPQOVGIIMH-UHFFFAOYSA-N
Compound name
(propan-2-ylideneamino) N-(3,4-dichlorophenyl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

260.01193 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 261.01921 154.0
[M+Na]+ 283.00115 162.9
[M-H]- 259.00465 158.8
[M+NH4]+ 278.04575 172.6
[M+K]+ 298.97509 158.9
[M+H-H2O]+ 243.00919 149.4
[M+HCOO]- 305.01013 171.1
[M+CH3COO]- 319.02578 199.3
[M+Na-2H]- 280.98660 157.5
[M]+ 260.01138 158.7
[M]- 260.01248 158.7
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

No patent data available for this compound.