CID 71756628

9-ethyl-1,4-dioxa-7-azaspiro[4.4]nonane

Structural Information

Molecular Formula
C8H15NO2
SMILES
CCC1CNCC12OCCO2
InChI
InChI=1S/C8H15NO2/c1-2-7-5-9-6-8(7)10-3-4-11-8/h7,9H,2-6H2,1H3
InChIKey
WAOSQYAZHHWOTE-UHFFFAOYSA-N
Compound name
9-ethyl-1,4-dioxa-7-azaspiro[4.4]nonane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

157.11028 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 158.11756 133.6
[M+Na]+ 180.09950 139.7
[M-H]- 156.10300 137.2
[M+NH4]+ 175.14410 155.4
[M+K]+ 196.07344 140.4
[M+H-H2O]+ 140.10754 128.9
[M+HCOO]- 202.10848 151.3
[M+CH3COO]- 216.12413 146.6
[M+Na-2H]- 178.08495 138.6
[M]+ 157.10973 130.1
[M]- 157.11083 130.1
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.