For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
7-[2-(2-acetamidophenyl)-1-oxoethyl]-3-ethyl-5-azabicyclo[2.2.2]oct-2-en-5-carbonsaure-methylester
SpectraBase Compound ID 9BBK1G0omqE
InChI InChI=1S/C21H26N2O4/c1-4-14-9-16-12-23(21(26)27-3)19(14)11-17(16)20(25)10-15-7-5-6-8-18(15)22-13(2)24/h5-9,16-17,19H,4,10-12H2,1-3H3,(H,22,24)/t16-,17?,19+/m0/s1
InChIKey MUOPJEPLGBZNCL-LVLJQFTKSA-N
Mol Weight 370.45 g/mol
Molecular Formula C21H26N2O4
Exact Mass 370.189257 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID FO7SReYC7nE
Name 7-[2-(2-acetamidophenyl)-1-oxoethyl]-3-ethyl-5-azabicyclo[2.2.2]oct-2-en-5-carbonsaure-methylester
CAS Registry Number 104760-75-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H26N2O4
InChI InChI=1S/C21H26N2O4/c1-4-14-9-16-12-23(21(26)27-3)19(14)11-17(16)20(25)10-15-7-5-6-8-18(15)22-13(2)24/h5-9,16-17,19H,4,10-12H2,1-3H3,(H,22,24)/t16-,17?,19+/m0/s1
InChIKey MUOPJEPLGBZNCL-LVLJQFTKSA-N
Molecular Weight 370.449 g/mol
SMILES N(c1c(CC(C2[C@@]3(CN([C@@](C(CC)=C3)(C2)[H])C(=O)OC)[H])=O)cccc1)C(=O)C
SPLASH splash10-014i-0900000000-13ecf677fa3ff36f6f04
Source of Spectrum H-68-1842-20
Synonyms Methyl 8-{[2-(acetylamino)phenyl]acetyl}-6-ethyl-2-azabicyclo[2.2.2]oct-5-ene-2-carboxylate
Wiley ID 1354373