CID 41638

55819-72-2

Structural Information

Molecular Formula

C₆H₁₅N₃O₂

SMILES

CC(C)NNC(=O)C(CO)N

InChI

InChI=1S/C6H15N3O2/c1-4(2)8-9-6(11)5(7)3-10/h4-5,8,10H,3,7H2,1-2H3,(H,9,11)

InChIKey

NIPOJNNSFDRMQO-UHFFFAOYSA-N

Compound name

2-amino-3-hydroxy-N'-propan-2-ylpropanehydrazide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 6
References: 1
Patents: 161.11642 Da
Monoisotopic Mass: -1.5
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]+	162.12370	137.7
[M+Na]+	184.10564	141.4
[M-H]-	160.10914	136.0
[M+NH4]+	179.15024	156.2
[M+K]+	200.07958	141.7
[M+H-H2O]+	144.11368	131.7
[M+HCOO]-	206.11462	159.9
[M+CH3COO]-	220.13027	184.1
[M+Na-2H]-	182.09109	139.7
[M]+	161.11587	133.5
[M]-	161.11697	133.5

Literature stripe

literature stripe

Patent stripe

patents stripe