CID 458408

2-methyl-n'-(4-methylbenzoyl)benzohydrazide

Structural Information

Molecular Formula

C₁₆H₁₆N₂O₂

SMILES

CC1=CC=C(C=C1)C(=O)NNC(=O)C2=CC=CC=C2C

InChI

InChI=1S/C16H16N2O2/c1-11-7-9-13(10-8-11)15(19)17-18-16(20)14-6-4-3-5-12(14)2/h3-10H,1-2H3,(H,17,19)(H,18,20)

InChIKey

NCJRIXODRZMUEC-UHFFFAOYSA-N

Compound name

2-methyl-N'-(4-methylbenzoyl)benzohydrazide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 7
Patents: 268.1212 Da
Monoisotopic Mass: 2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	269.128476	162.3
[M+Na]+	291.110418	168.3
[M-H]-	267.113924	169.2
[M+NH4]+	286.155023	178.0
[M+K]+	307.084358	164.9
[M+H-H2O]+	251.118460	154.3
[M+HCOO]-	313.119401	186.9
[M+CH3COO]-	327.135051	202.5
[M+Na-2H]-	289.095866	166.2
[M]+	268.12065142	161.4
[M]-	268.12174858	161.4

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe