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

2
Patents

184.12119 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 185.128466 142.3
[M+Na]+ 207.110408 147.8
[M-H]- 183.113914 142.3
[M+NH4]+ 202.155013 160.5
[M+K]+ 223.084348 145.7
[M+H-H2O]+ 167.118450 135.8
[M+HCOO]- 229.119391 155.8
[M+CH3COO]- 243.135041 173.2
[M+Na-2H]- 205.095856 146.0
[M]+ 184.12064142 134.7
[M]- 184.12173858 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