CID 466854

Chembl33193

Structural Information

Molecular Formula
C16H18N2O4
SMILES
C1=CC=C(C=C1)OCC(CNNC(=O)C2=CC=CC=C2O)O
InChI
InChI=1S/C16H18N2O4/c19-12(11-22-13-6-2-1-3-7-13)10-17-18-16(21)14-8-4-5-9-15(14)20/h1-9,12,17,19-20H,10-11H2,(H,18,21)
InChIKey
CKTQVJWQTJRMCI-UHFFFAOYSA-N
Compound name
2-hydroxy-N'-(2-hydroxy-3-phenoxypropyl)benzohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

0
Patents

302.12665 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 303.13393 167.9
[M+Na]+ 325.11587 171.2
[M-H]- 301.11937 171.4
[M+NH4]+ 320.16047 180.1
[M+K]+ 341.08981 168.1
[M+H-H2O]+ 285.12391 159.4
[M+HCOO]- 347.12485 189.6
[M+CH3COO]- 361.14050 203.1
[M+Na-2H]- 323.10132 171.8
[M]+ 302.12610 166.5
[M]- 302.12720 166.5
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.