CID 124251459

2-{1,4-dioxa-7-azaspiro[4.4]nonan-7-yl}ethan-1-amine

Structural Information

Molecular Formula
C8H16N2O2
SMILES
C1CN(CC12OCCO2)CCN
InChI
InChI=1S/C8H16N2O2/c9-2-4-10-3-1-8(7-10)11-5-6-12-8/h1-7,9H2
InChIKey
JMHVMNXRCQUJCQ-UHFFFAOYSA-N
Compound name
2-(1,4-dioxa-7-azaspiro[4.4]nonan-7-yl)ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

172.12119 Da
Monoisotopic Mass

-1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 173.12847 136.5
[M+Na]+ 195.11041 142.0
[M-H]- 171.11391 140.9
[M+NH4]+ 190.15501 157.7
[M+K]+ 211.08435 143.2
[M+H-H2O]+ 155.11845 131.0
[M+HCOO]- 217.11939 156.1
[M+CH3COO]- 231.13504 176.6
[M+Na-2H]- 193.09586 141.5
[M]+ 172.12064 133.1
[M]- 172.12174 133.1
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

No patent data available for this compound.