CID 3015363

N-amidinodecan-1-amide

Structural Information

Molecular Formula

C₁₁H₂₃N₃O

SMILES

CCCCCCCCCC(=O)N=C(N)N

InChI

InChI=1S/C11H23N3O/c1-2-3-4-5-6-7-8-9-10(15)14-11(12)13/h2-9H2,1H3,(H4,12,13,14,15)

InChIKey

LIEUIAOUJMFOJB-UHFFFAOYSA-N

Compound name

N-(diaminomethylidene)decanamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 4
Patents: 213.18411 Da
Monoisotopic Mass: 3.3
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]+	214.191386	155.2
[M+Na]+	236.173328	158.4
[M-H]-	212.176834	155.0
[M+NH4]+	231.217933	173.1
[M+K]+	252.147268	157.3
[M+H-H2O]+	196.181370	148.2
[M+HCOO]-	258.182311	179.2
[M+CH3COO]-	272.197961	198.9
[M+Na-2H]-	234.158776	156.0
[M]+	213.18356142	154.3
[M]-	213.18465858	154.3

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe