CID 212024

23804-80-0

Structural Information

Molecular Formula
C15H21N3O2
SMILES
C1CN(CCC12CNC(=O)O2)CCC3=CC=C(C=C3)N
InChI
InChI=1S/C15H21N3O2/c16-13-3-1-12(2-4-13)5-8-18-9-6-15(7-10-18)11-17-14(19)20-15/h1-4H,5-11,16H2,(H,17,19)
InChIKey
NTMFJZKPNPTJHA-UHFFFAOYSA-N
Compound name
8-[2-(4-aminophenyl)ethyl]-1-oxa-3,8-diazaspiro[4.5]decan-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

275.1634 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 276.17068 166.0
[M+Na]+ 298.15262 175.8
[M+NH4]+ 293.19722 174.3
[M+K]+ 314.12656 170.0
[M-H]- 274.15612 170.3
[M+Na-2H]- 296.13807 171.6
[M]+ 275.16285 168.4
[M]- 275.16395 168.4
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.