CID 129928158

2-ethyl-1-oxa-4,8-diazaspiro[4.5]decan-3-one hydrobromide

Structural Information

Molecular Formula
C9H16N2O2
SMILES
CCC1C(=O)NC2(O1)CCNCC2
InChI
InChI=1S/C9H16N2O2/c1-2-7-8(12)11-9(13-7)3-5-10-6-4-9/h7,10H,2-6H2,1H3,(H,11,12)
InChIKey
GJBNZVUQEZBTLD-UHFFFAOYSA-N
Compound name
2-ethyl-1-oxa-4,8-diazaspiro[4.5]decan-3-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

184.12119 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 185.12847 142.3
[M+Na]+ 207.11041 147.8
[M-H]- 183.11391 142.3
[M+NH4]+ 202.15501 160.5
[M+K]+ 223.08435 145.7
[M+H-H2O]+ 167.11845 135.8
[M+HCOO]- 229.11939 155.8
[M+CH3COO]- 243.13504 173.2
[M+Na-2H]- 205.09586 146.0
[M]+ 184.12064 134.7
[M]- 184.12174 134.7
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