CID 199813

Brn 0568651

Structural Information

Molecular Formula
C17H23N3O4
SMILES
CCOC1=CC=C(C=C1)NC(=O)CN2CCC3(CC2)CNC(=O)O3
InChI
InChI=1S/C17H23N3O4/c1-2-23-14-5-3-13(4-6-14)19-15(21)11-20-9-7-17(8-10-20)12-18-16(22)24-17/h3-6H,2,7-12H2,1H3,(H,18,22)(H,19,21)
InChIKey
YJWOYDDERYHYQU-UHFFFAOYSA-N
Compound name
N-(4-ethoxyphenyl)-2-(2-oxo-1-oxa-3,8-diazaspiro[4.5]decan-8-yl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

333.16885 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 334.17613 177.8
[M+Na]+ 356.15807 181.3
[M-H]- 332.16157 182.1
[M+NH4]+ 351.20267 189.7
[M+K]+ 372.13201 178.8
[M+H-H2O]+ 316.16611 168.6
[M+HCOO]- 378.16705 192.1
[M+CH3COO]- 392.18270 205.9
[M+Na-2H]- 354.14352 179.2
[M]+ 333.16830 173.5
[M]- 333.16940 173.5
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.