CID 3087533

Brn 5968373

Structural Information

Molecular Formula
C15H19N3O2
SMILES
C1CN(CCC12C(=O)NC(=O)N2)CCC3=CC=CC=C3
InChI
InChI=1S/C15H19N3O2/c19-13-15(17-14(20)16-13)7-10-18(11-8-15)9-6-12-4-2-1-3-5-12/h1-5H,6-11H2,(H2,16,17,19,20)
InChIKey
FOXJEXULBUEGCA-UHFFFAOYSA-N
Compound name
8-(2-phenylethyl)-1,3,8-triazaspiro[4.5]decane-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

273.14774 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 274.15502 166.1
[M+Na]+ 296.13696 171.5
[M-H]- 272.14046 167.3
[M+NH4]+ 291.18156 180.3
[M+K]+ 312.11090 165.6
[M+H-H2O]+ 256.14500 156.7
[M+HCOO]- 318.14594 178.9
[M+CH3COO]- 332.16159 174.7
[M+Na-2H]- 294.12241 167.3
[M]+ 273.14719 157.7
[M]- 273.14829 157.7
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

No patent data available for this compound.