CID 199091

Pc 614

Structural Information

Molecular Formula

C₇H₁₆N₂O₂

SMILES

CC(C)NNC(=O)CCCO

InChI

InChI=1S/C7H16N2O2/c1-6(2)8-9-7(11)4-3-5-10/h6,8,10H,3-5H2,1-2H3,(H,9,11)

InChIKey

SFCAJVLMRPMFBW-UHFFFAOYSA-N

Compound name

4-hydroxy-N'-propan-2-ylbutanehydrazide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 4
Patents: 160.12119 Da
Monoisotopic Mass: -0.3
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]+	161.12847	137.9
[M+Na]+	183.11041	142.3
[M-H]-	159.11391	136.6
[M+NH4]+	178.15501	157.3
[M+K]+	199.08435	142.1
[M+H-H2O]+	143.11845	132.3
[M+HCOO]-	205.11939	160.5
[M+CH3COO]-	219.13504	181.5
[M+Na-2H]-	181.09586	141.6
[M]+	160.12064	136.7
[M]-	160.12174	136.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe