CID 135683322

N'-(2,4-dihydroxybenzylidene)-2-(4-nitrophenoxy)propanohydrazide

Structural Information

Molecular Formula
C16H15N3O6
SMILES
CC(C(=O)N/N=C/C1=C(C=C(C=C1)O)O)OC2=CC=C(C=C2)[N+](=O)[O-]
InChI
InChI=1S/C16H15N3O6/c1-10(25-14-6-3-12(4-7-14)19(23)24)16(22)18-17-9-11-2-5-13(20)8-15(11)21/h2-10,20-21H,1H3,(H,18,22)/b17-9+
InChIKey
NTXKQYVGLPPODU-RQZCQDPDSA-N
Compound name
N-[(E)-(2,4-dihydroxyphenyl)methylideneamino]-2-(4-nitrophenoxy)propanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

345.0961 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 346.10338 174.1
[M+Na]+ 368.08532 177.8
[M-H]- 344.08882 179.5
[M+NH4]+ 363.12992 184.5
[M+K]+ 384.05926 171.6
[M+H-H2O]+ 328.09336 169.8
[M+HCOO]- 390.09430 198.3
[M+CH3COO]- 404.10995 207.2
[M+Na-2H]- 366.07077 178.9
[M]+ 345.09555 173.1
[M]- 345.09665 173.1
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.