CID 135770365

Brn 4206265

Structural Information

Molecular Formula
C16H15ClN4O3
SMILES
C/C(=N\N=C\C1=C(C=C(C=C1)O)O)/C(=NC2=CC=C(C=C2)Cl)NO
InChI
InChI=1S/C16H15ClN4O3/c1-10(16(21-24)19-13-5-3-12(17)4-6-13)20-18-9-11-2-7-14(22)8-15(11)23/h2-9,22-24H,1H3,(H,19,21)/b18-9+,20-10+
InChIKey
NLANOAMFOIYLRG-WEUCRPADSA-N
Compound name
(2E)-N'-(4-chlorophenyl)-2-[(E)-(2,4-dihydroxyphenyl)methylidenehydrazinylidene]-N-hydroxypropanimidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

346.08328 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 347.09056 179.4
[M+Na]+ 369.07250 185.5
[M-H]- 345.07600 186.4
[M+NH4]+ 364.11710 192.3
[M+K]+ 385.04644 180.8
[M+H-H2O]+ 329.08054 171.5
[M+HCOO]- 391.08148 201.9
[M+CH3COO]- 405.09713 218.9
[M+Na-2H]- 367.05795 182.9
[M]+ 346.08273 180.6
[M]- 346.08383 180.6
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.