CID 3024663

3-(2,2-dimethyl-1-propionylhydrazino)propionitrile

Structural Information

Molecular Formula

C₈H₁₅N₃O

SMILES

CCC(=O)N(CCC#N)N(C)C

InChI

InChI=1S/C8H15N3O/c1-4-8(12)11(10(2)3)7-5-6-9/h4-5,7H2,1-3H3

InChIKey

TUZICURVJCEKLK-UHFFFAOYSA-N

Compound name

N-(2-cyanoethyl)-N',N'-dimethylpropanehydrazide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 169.1215 Da
Monoisotopic Mass: 0.1
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]+	170.12878	138.8
[M+Na]+	192.11072	145.5
[M-H]-	168.11422	141.7
[M+NH4]+	187.15532	157.7
[M+K]+	208.08466	147.6
[M+H-H2O]+	152.11876	126.0
[M+HCOO]-	214.11970	160.5
[M+CH3COO]-	228.13535	203.6
[M+Na-2H]-	190.09617	142.3
[M]+	169.12095	136.3
[M]-	169.12205	136.3

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe