CID 135599740

Brn 4810552

Structural Information

Molecular Formula
C11H11Cl2N3O2
SMILES
C/C(=C(\C(=O)NC)/N=NC1=CC(=C(C=C1)Cl)Cl)/O
InChI
InChI=1S/C11H11Cl2N3O2/c1-6(17)10(11(18)14-2)16-15-7-3-4-8(12)9(13)5-7/h3-5,17H,1-2H3,(H,14,18)/b10-6-,16-15?
InChIKey
ZUWBTCAIMWTRRG-MXEOBWLSSA-N
Compound name
(Z)-2-[(3,4-dichlorophenyl)diazenyl]-3-hydroxy-N-methylbut-2-enamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

287.02283 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 288.03011 162.9
[M+Na]+ 310.01205 170.5
[M-H]- 286.01555 167.6
[M+NH4]+ 305.05665 179.8
[M+K]+ 325.98599 166.2
[M+H-H2O]+ 270.02009 157.9
[M+HCOO]- 332.02103 179.9
[M+CH3COO]- 346.03668 207.4
[M+Na-2H]- 307.99750 164.9
[M]+ 287.02228 166.0
[M]- 287.02338 166.0
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.