| SpectraBase Spectrum ID |
DHjGmaxJQBM |
| Name |
Phenyl 7-(4-methoxy-4-oxobutyl)-9-azabicyclo[4.2.1]nona-2,4,7-triene-9-carboxylate |
| Appearance |
Yellowish oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H21NO4 |
| InChI |
InChI=1S/C20H21NO4/c1-24-19(22)13-7-8-15-14-16-9-5-6-12-18(15)21(16)20(23)25-17-10-3-2-4-11-17/h2-6,9-12,14,16,18H,7-8,13H2,1H3/t16-,18+/m0/s1 |
| InChIKey |
FKAZFIYJCLAGQI-FUHWJXTLSA-N |
| Instrument Name |
Shimadzu GC??MS-QP2010 Plus |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/ejoc.201901837 |
| Molecular Weight |
339.391 g/mol |
| Reported Formula |
C20H21NO4 |
| SMILES |
[C@]12(N([C@](C=C2CCCC(OC)=O)(C=CC=C1)[H])C(=O)Oc1ccccc1)[H] |
| SPLASH |
splash10-00p0-6930000000-0a76e39ff47acb07bf36 |
| Source of Spectrum |
U1-2020-SM16-3bh |
| Thin-Layer Chromatography |
Rf = 0.46 (petroleum ether/ethyl acetate 15:1, 10:1, 5:1) |
| Wiley ID |
1858972 |
![Phenyl 7-(4-methoxy-4-oxobutyl)-9-azabicyclo[4.2.1]nona-2,4,7-triene-9-carboxylate](/api/spectrum/DHjGmaxJQBM/structure.png?h=300&w=458 "Phenyl 7-(4-methoxy-4-oxobutyl)-9-azabicyclo[4.2.1]nona-2,4,7-triene-9-carboxylate")
