CID 1538511

N-1-adamantylhydrazinecarboxamide

Structural Information

Molecular Formula

C₁₁H₁₉N₃O

SMILES

C1C2CC3CC1CC(C2)(C3)NC(=O)NN

InChI

InChI=1S/C11H19N3O/c12-14-10(15)13-11-4-7-1-8(5-11)3-9(2-7)6-11/h7-9H,1-6,12H2,(H2,13,14,15)

InChIKey

OZUYDSURXVXCJV-UHFFFAOYSA-N

Compound name

1-(1-adamantyl)-3-aminourea

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 1
Patents: 209.15282 Da
Monoisotopic Mass: 1.3
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]+	210.16010	142.7
[M+Na]+	232.14204	143.5
[M-H]-	208.14554	137.3
[M+NH4]+	227.18664	167.2
[M+K]+	248.11598	141.4
[M+H-H2O]+	192.15008	137.3
[M+HCOO]-	254.15102	152.2
[M+CH3COO]-	268.16667	151.0
[M+Na-2H]-	230.12749	154.7
[M]+	209.15227	139.3
[M]-	209.15337	139.3

Literature stripe

literature stripe

Patent stripe

patents stripe