CID 485680

N-[(3-(4h,6h-benzo[e]imidazolo[2,1-c]1,4-oxazaperhydroepin-8-yl)(5s)-2-oxo-1,3-oxazolidin-5-yl)methyl]acetamide

Structural Information

Molecular Formula
C17H18N4O4
SMILES
CC(=O)NC[C@H]1CN(C(=O)O1)C2=CC3=C(C=C2)N4C=CN=C4COC3
InChI
InChI=1S/C17H18N4O4/c1-11(22)19-7-14-8-21(17(23)25-14)13-2-3-15-12(6-13)9-24-10-16-18-4-5-20(15)16/h2-6,14H,7-10H2,1H3,(H,19,22)/t14-/m0/s1
InChIKey
RJJRNQIIJWCFIS-AWEZNQCLSA-N
Compound name
N-[[(5S)-3-(4,6-dihydroimidazo[1,2-a][4,1]benzoxazepin-8-yl)-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

342.1328 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 343.14008 178.5
[M+Na]+ 365.12202 185.3
[M-H]- 341.12552 186.1
[M+NH4]+ 360.16662 189.7
[M+K]+ 381.09596 186.5
[M+H-H2O]+ 325.13006 169.6
[M+HCOO]- 387.13100 193.6
[M+CH3COO]- 401.14665 188.3
[M+Na-2H]- 363.10747 179.3
[M]+ 342.13225 177.7
[M]- 342.13335 177.7
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.