CID 68308237

4-ethyl-4,7-diazaspiro[2.5]octane dihydrochloride

Structural Information

Molecular Formula
C8H16N2
SMILES
CCN1CCNCC12CC2
InChI
InChI=1S/C8H16N2/c1-2-10-6-5-9-7-8(10)3-4-8/h9H,2-7H2,1H3
InChIKey
IHHSGFCGZKLBKI-UHFFFAOYSA-N
Compound name
4-ethyl-4,7-diazaspiro[2.5]octane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

140.13135 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 141.138626 139.7
[M+Na]+ 163.120568 147.5
[M-H]- 139.124074 141.6
[M+NH4]+ 158.165173 155.3
[M+K]+ 179.094508 145.1
[M+H-H2O]+ 123.128610 132.7
[M+HCOO]- 185.129551 156.3
[M+CH3COO]- 199.145201 174.4
[M+Na-2H]- 161.106016 146.1
[M]+ 140.13080142 136.3
[M]- 140.13189858 136.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe