CID 23383278

17740-45-3

Structural Information

Molecular Formula

C₈H₁₆N₂

SMILES

CN1CC2CCC(C1)N2C

InChI

InChI=1S/C8H16N2/c1-9-5-7-3-4-8(6-9)10(7)2/h7-8H,3-6H2,1-2H3

InChIKey

HWTLFOPXWFNIAJ-UHFFFAOYSA-N

Compound name

3,8-dimethyl-3,8-diazabicyclo[3.2.1]octane

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 303
Patents: 140.13135 Da
Monoisotopic Mass: 0.7
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]+	141.138626	132.2
[M+Na]+	163.120568	139.6
[M-H]-	139.124074	132.0
[M+NH4]+	158.165173	154.9
[M+K]+	179.094508	138.0
[M+H-H2O]+	123.128610	125.9
[M+HCOO]-	185.129551	149.1
[M+CH3COO]-	199.145201	176.1
[M+Na-2H]-	161.106016	136.8
[M]+	140.13080142	129.2
[M]-	140.13189858	129.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe