CID 28815

Abbott

Structural Information

Molecular Formula

C₈H₁₅N₃O₂

SMILES

CC(C)N1C(=O)NC(=O)N1C(C)C

InChI

InChI=1S/C8H15N3O2/c1-5(2)10-7(12)9-8(13)11(10)6(3)4/h5-6H,1-4H3,(H,9,12,13)

InChIKey

FUPIHZLHPHQVJZ-UHFFFAOYSA-N

Compound name

1,2-di(propan-2-yl)-1,2,4-triazolidine-3,5-dione

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 5
References: 0
Patents: 185.11642 Da
Monoisotopic Mass: 0.9
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]+	186.12370	140.8
[M+Na]+	208.10564	151.2
[M+NH4]+	203.15024	146.0
[M+K]+	224.07958	149.8
[M-H]-	184.10914	138.4
[M+Na-2H]-	206.09109	143.2
[M]+	185.11587	141.1
[M]-	185.11697	141.1

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.