CID 9555016

Hippuric n-(4-methylbenzylidene)hydrazide

Structural Information

Molecular Formula
C17H17N3O2
SMILES
CC1=CC=C(C=C1)/C=N/NC(=O)CNC(=O)C2=CC=CC=C2
InChI
InChI=1S/C17H17N3O2/c1-13-7-9-14(10-8-13)11-19-20-16(21)12-18-17(22)15-5-3-2-4-6-15/h2-11H,12H2,1H3,(H,18,22)(H,20,21)/b19-11+
InChIKey
YTSHSKRWVYFSLD-YBFXNURJSA-N
Compound name
N-[2-[(2E)-2-[(4-methylphenyl)methylidene]hydrazinyl]-2-oxoethyl]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

295.13208 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 296.139356 169.1
[M+Na]+ 318.121298 173.4
[M-H]- 294.124804 176.7
[M+NH4]+ 313.165903 183.5
[M+K]+ 334.095238 170.1
[M+H-H2O]+ 278.129340 159.9
[M+HCOO]- 340.130281 196.0
[M+CH3COO]- 354.145931 211.1
[M+Na-2H]- 316.106746 174.0
[M]+ 295.13153142 168.5
[M]- 295.13262858 168.5
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.