CID 3069635

84966-94-9

Structural Information

Molecular Formula

C₁₄H₁₈N₄O₄

SMILES

CC(=O)NC1=CC=CC=C1C(=O)C(=O)NNC(=O)CN(C)C

InChI

InChI=1S/C14H18N4O4/c1-9(19)15-11-7-5-4-6-10(11)13(21)14(22)17-16-12(20)8-18(2)3/h4-7H,8H2,1-3H3,(H,15,19)(H,16,20)(H,17,22)

InChIKey

GFAHXOGHHLIDQP-UHFFFAOYSA-N

Compound name

N-[2-[2-[2-[2-(dimethylamino)acetyl]hydrazinyl]-2-oxoacetyl]phenyl]acetamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 306.1328 Da
Monoisotopic Mass: 0.4
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]+	307.140076	171.5
[M+Na]+	329.122018	174.3
[M-H]-	305.125524	176.2
[M+NH4]+	324.166623	185.2
[M+K]+	345.095958	175.0
[M+H-H2O]+	289.130060	163.0
[M+HCOO]-	351.131001	196.6
[M+CH3COO]-	365.146651	217.4
[M+Na-2H]-	327.107466	172.1
[M]+	306.13225142	171.8
[M]-	306.13334858	171.8

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.