CID 135458840

Benzoic (2,4-dihydroxybenzylidene)hydrazide

Structural Information

Molecular Formula
C14H12N2O3
SMILES
C1=CC=C(C=C1)C(=O)N/N=C/C2=C(C=C(C=C2)O)O
InChI
InChI=1S/C14H12N2O3/c17-12-7-6-11(13(18)8-12)9-15-16-14(19)10-4-2-1-3-5-10/h1-9,17-18H,(H,16,19)/b15-9+
InChIKey
CCCOIIPPDUTXBS-OQLLNIDSSA-N
Compound name
N-[(E)-(2,4-dihydroxyphenyl)methylideneamino]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

2
Patents

256.08478 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 257.09206 155.5
[M+Na]+ 279.07400 162.0
[M-H]- 255.07750 161.3
[M+NH4]+ 274.11860 170.9
[M+K]+ 295.04794 158.3
[M+H-H2O]+ 239.08204 147.7
[M+HCOO]- 301.08298 180.5
[M+CH3COO]- 315.09863 196.1
[M+Na-2H]- 277.05945 161.3
[M]+ 256.08423 154.2
[M]- 256.08533 154.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe