CID 24689256

3-(2-bromoethyl)-1,3-diazaspiro[4.4]nonane-2,4-dione

Structural Information

Molecular Formula
C9H13BrN2O2
SMILES
C1CCC2(C1)C(=O)N(C(=O)N2)CCBr
InChI
InChI=1S/C9H13BrN2O2/c10-5-6-12-7(13)9(11-8(12)14)3-1-2-4-9/h1-6H2,(H,11,14)
InChIKey
YMGZPVIVRDIJAI-UHFFFAOYSA-N
Compound name
3-(2-bromoethyl)-1,3-diazaspiro[4.4]nonane-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

260.01605 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 261.023326 152.5
[M+Na]+ 283.005268 163.8
[M-H]- 259.008774 157.1
[M+NH4]+ 278.049873 175.4
[M+K]+ 298.979208 152.8
[M+H-H2O]+ 243.013310 153.0
[M+HCOO]- 305.014251 169.1
[M+CH3COO]- 319.029901 186.3
[M+Na-2H]- 280.990716 155.3
[M]+ 260.01550142 167.1
[M]- 260.01659858 167.1
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.