| SpectraBase Spectrum ID |
5E7308CteE9 |
| Name |
Ethyl 7-(3-hydroxypropyl)-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 |
C14H19NO3 |
| InChI |
InChI=1S/C14H19NO3/c1-2-18-14(17)15-12-7-3-4-8-13(15)11(10-12)6-5-9-16/h3-4,7-8,10,12-13,16H,2,5-6,9H2,1H3/t12-,13+/m0/s1 |
| InChIKey |
FLIXDQDXDYOSMP-QWHCGFSZSA-N |
| Instrument Name |
Shimadzu GC??MS-QP2010 Plus |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/ejoc.201901837 |
| Molecular Weight |
249.310 g/mol |
| Reported Formula |
C14H19NO3 |
| SMILES |
OCCCC1=C[C@]2(N([C@@]1(C=CC=C2)[H])C(=O)OCC)[H] |
| SPLASH |
splash10-00kf-2900000000-291915fc6e12f2723516 |
| Source of Spectrum |
U1-2020-SM5-3ac |
| Thin-Layer Chromatography |
Rf = 0.50 (petroleum ether/ethyl acetate 15:1, 10:1, 5:1) |
| Wiley ID |
1858956 |
![Ethyl 7-(3-hydroxypropyl)-9-azabicyclo[4.2.1]nona-2,4,7-triene-9-carboxylate](/api/spectrum/5E7308CteE9/structure.png?h=300&w=458 "Ethyl 7-(3-hydroxypropyl)-9-azabicyclo[4.2.1]nona-2,4,7-triene-9-carboxylate")
