CID 3024534

Guanidine, 3-cyano-1,1-dibutyl-

Structural Information

Molecular Formula

C₁₀H₂₀N₄

SMILES

CCCCN(CCCC)C(=NC#N)N

InChI

InChI=1S/C10H20N4/c1-3-5-7-14(8-6-4-2)10(12)13-9-11/h3-8H2,1-2H3,(H2,12,13)

InChIKey

QLTMXLGLZSRPRH-UHFFFAOYSA-N

Compound name

1,1-dibutyl-2-cyanoguanidine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 4
Patents: 196.1688 Da
Monoisotopic Mass: 2.0
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]+	197.17608	152.3
[M+Na]+	219.15802	159.0
[M+NH4]+	214.20262	155.6
[M+K]+	235.13196	150.5
[M-H]-	195.16152	146.1
[M+Na-2H]-	217.14347	152.5
[M]+	196.16825	150.2
[M]-	196.16935	150.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe