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]+ 173.128466 136.5
[M+Na]+ 195.110408 142.0
[M-H]- 171.113914 140.9
[M+NH4]+ 190.155013 157.7
[M+K]+ 211.084348 143.2
[M+H-H2O]+ 155.118450 131.0
[M+HCOO]- 217.119391 156.1
[M+CH3COO]- 231.135041 176.6
[M+Na-2H]- 193.095856 141.5
[M]+ 172.12064142 133.1
[M]- 172.12173858 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.