CID 32272

24280-74-8

Structural Information

Molecular Formula

C₁₀H₁₇N

SMILES

C1C2CC3CC1CC(C2)NC3

InChI

InChI=1S/C10H17N/c1-7-2-9-3-8(1)5-10(4-7)11-6-9/h7-11H,1-6H2

InChIKey

CRKHNIDATUGNFE-UHFFFAOYSA-N

Compound name

4-azatricyclo[4.3.1.13,8]undecane

Related CIDs

2D Structure

compound 2d structure

3
Annotation Hits: 2
References: 248
Patents: 151.1361 Da
Monoisotopic Mass: 1.9
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]+	152.143376	142.0
[M+Na]+	174.125318	148.9
[M-H]-	150.128824	141.1
[M+NH4]+	169.169923	163.8
[M+K]+	190.099258	143.5
[M+H-H2O]+	134.133360	142.9
[M+HCOO]-	196.134301	149.5
[M+CH3COO]-	210.149951	151.2
[M+Na-2H]-	172.110766	152.4
[M]+	151.13555142	138.4
[M]-	151.13664858	138.4

Literature stripe

literature stripe

Patent stripe

patents stripe