CID 22600

Isobutyric acid, 2-isopropylhydrazide

Structural Information

Molecular Formula

C₇H₁₆N₂O

SMILES

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

InChI

InChI=1S/C7H16N2O/c1-5(2)7(10)9-8-6(3)4/h5-6,8H,1-4H3,(H,9,10)

InChIKey

PTGXSXYMEHNCCN-UHFFFAOYSA-N

Compound name

2-methyl-N'-propan-2-ylpropanehydrazide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 56
Patents: 144.12627 Da
Monoisotopic Mass: 1.1
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]+	145.133546	135.3
[M+Na]+	167.115488	140.0
[M-H]-	143.118994	135.6
[M+NH4]+	162.160093	156.1
[M+K]+	183.089428	140.7
[M+H-H2O]+	127.123530	129.9
[M+HCOO]-	189.124471	158.2
[M+CH3COO]-	203.140121	182.9
[M+Na-2H]-	165.100936	138.2
[M]+	144.12572142	133.9
[M]-	144.12681858	133.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe