CID 44996

Nonylguanidine hydroiodide

Structural Information

Molecular Formula

C₁₀H₂₃N₃

SMILES

CCCCCCCCCN=C(N)N

InChI

InChI=1S/C10H23N3/c1-2-3-4-5-6-7-8-9-13-10(11)12/h2-9H2,1H3,(H4,11,12,13)

InChIKey

QKVSKRWNJXMUAQ-UHFFFAOYSA-N

Compound name

2-nonylguanidine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 6
References: 131
Patents: 185.1892 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]+	186.19648	147.9
[M+Na]+	208.17842	151.4
[M-H]-	184.18192	147.7
[M+NH4]+	203.22302	167.0
[M+K]+	224.15236	150.1
[M+H-H2O]+	168.18646	141.1
[M+HCOO]-	230.18740	172.8
[M+CH3COO]-	244.20305	194.6
[M+Na-2H]-	206.16387	150.5
[M]+	185.18865	146.6
[M]-	185.18975	146.6

Literature stripe

literature stripe

Patent stripe

patents stripe