CID 19375496

2,8-diazaspiro[4.5]decane

Structural Information

Molecular Formula

C₈H₁₆N₂

SMILES

C1CNCCC12CCNC2

InChI

InChI=1S/C8H16N2/c1-4-9-5-2-8(1)3-6-10-7-8/h9-10H,1-7H2

InChIKey

WYZZNMWIWHRXRM-UHFFFAOYSA-N

Compound name

2,8-diazaspiro[4.5]decane

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 2273
Patents: 140.13135 Da
Monoisotopic Mass: 0.1
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	134.2
[M+Na]+	163.120568	138.0
[M-H]-	139.124074	133.0
[M+NH4]+	158.165173	155.0
[M+K]+	179.094508	135.0
[M+H-H2O]+	123.128610	127.1
[M+HCOO]-	185.129551	148.4
[M+CH3COO]-	199.145201	144.6
[M+Na-2H]-	161.106016	138.8
[M]+	140.13080142	122.6
[M]-	140.13189858	122.6

Literature stripe

literature stripe

Patent stripe

patents stripe