CID 3015454

P-butoxybenzamidine hydrochloride

Structural Information

Molecular Formula

C₁₁H₁₆N₂O

SMILES

CCCCOC1=CC=C(C=C1)C(=N)N

InChI

InChI=1S/C11H16N2O/c1-2-3-8-14-10-6-4-9(5-7-10)11(12)13/h4-7H,2-3,8H2,1H3,(H3,12,13)

InChIKey

SQOXELSMFMHGED-UHFFFAOYSA-N

Compound name

4-butoxybenzenecarboximidamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 27
Patents: 192.12627 Da
Monoisotopic Mass: 2.6
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]+	193.13355	144.2
[M+Na]+	215.11549	154.5
[M+NH4]+	210.16009	151.9
[M+K]+	231.08943	148.4
[M-H]-	191.11899	146.9
[M+Na-2H]-	213.10094	150.1
[M]+	192.12572	146.1
[M]-	192.12682	146.1

Literature stripe

literature stripe

Patent stripe

patents stripe