CID 216925

37853-39-7

Structural Information

Molecular Formula
C15H19N3O3
SMILES
C1CCCN(CC1)CC(=O)NC2=CC(=NO2)C3=CC=CO3
InChI
InChI=1S/C15H19N3O3/c19-14(11-18-7-3-1-2-4-8-18)16-15-10-12(17-21-15)13-6-5-9-20-13/h5-6,9-10H,1-4,7-8,11H2,(H,16,19)
InChIKey
GVBIWDXESRLBSO-UHFFFAOYSA-N
Compound name
2-(azepan-1-yl)-N-[3-(furan-2-yl)-1,2-oxazol-5-yl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

289.14264 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 290.14992 171.8
[M+Na]+ 312.13186 180.1
[M+NH4]+ 307.17646 177.3
[M+K]+ 328.10580 180.1
[M-H]- 288.13536 176.8
[M+Na-2H]- 310.11731 176.7
[M]+ 289.14209 174.2
[M]- 289.14319 174.2
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.