CID 9576162

3-methyl-2-butanone phenylhydrazone

Structural Information

Molecular Formula

C₁₁H₁₆N₂

SMILES

CC(C)/C(=N/NC1=CC=CC=C1)/C

InChI

InChI=1S/C11H16N2/c1-9(2)10(3)12-13-11-7-5-4-6-8-11/h4-9,13H,1-3H3/b12-10+

InChIKey

FMMTYPMNEMQQSY-ZRDIBKRKSA-N

Compound name

N-[(E)-3-methylbutan-2-ylideneamino]aniline

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 2
Patents: 176.13135 Da
Monoisotopic Mass: 3.1
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]+	177.13863	140.9
[M+Na]+	199.12057	146.0
[M-H]-	175.12407	145.6
[M+NH4]+	194.16517	161.0
[M+K]+	215.09451	144.8
[M+H-H2O]+	159.12861	134.2
[M+HCOO]-	221.12955	166.6
[M+CH3COO]-	235.14520	189.9
[M+Na-2H]-	197.10602	146.6
[M]+	176.13080	139.9
[M]-	176.13190	139.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe