CID 56531

Brn 2359533

Structural Information

Molecular Formula

C₅H₁₂N₄O₂

SMILES

CC(C)NNC(=O)C(=O)NN

InChI

InChI=1S/C5H12N4O2/c1-3(2)8-9-5(11)4(10)7-6/h3,8H,6H2,1-2H3,(H,7,10)(H,9,11)

InChIKey

JWIHWSUHUHGYGL-UHFFFAOYSA-N

Compound name

2-N'-propan-2-ylethanedihydrazide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 2
Patents: 160.09602 Da
Monoisotopic Mass: 0.2
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]+	161.10330	135.1
[M+Na]+	183.08524	139.3
[M-H]-	159.08874	135.1
[M+NH4]+	178.12984	154.1
[M+K]+	199.05918	140.2
[M+H-H2O]+	143.09328	128.6
[M+HCOO]-	205.09422	160.4
[M+CH3COO]-	219.10987	186.6
[M+Na-2H]-	181.07069	138.4
[M]+	160.09547	130.8
[M]-	160.09657	130.8

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe