| SpectraBase Spectrum ID |
6MzuR2VB66Q |
| Name |
trans-4,5-dihydro-5-phenyl-3-(2,4,6-trimethylphenyl)-4-isoxazolecarboxylic acid ethyl ester |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
337.167793602 u |
| Formula |
C21H23NO3 |
| InChI |
InChI=1S/C21H23NO3/c1-5-24-21(23)18-19(17-14(3)11-13(2)12-15(17)4)22-25-20(18)16-9-7-6-8-10-16/h6-12,18,20H,5H2,1-4H3/t18-,20+/m1/s1 |
| InChIKey |
LAZYYECOBRHSRK-QUCCMNQESA-N |
| Instrument Name |
VG Micromass 7070F or AEI MS-30 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.3998/ark.5550190.0002.c05 |
| Molecular Weight |
337.419 g/mol |
| Quality |
68 |
| SMILES |
[C@]1([C@@](C(=NO1)C1=C(C=C(C=C1C)C)C)(C(OCC)=O)[H])(C1=CC=CC=C1)[H] |
| SPLASH |
splash10-0f79-0905000000-2857a3576806b1d4164a |
| Source of Spectrum |
ARK-2001-41-7b, (+ or -)-7b (DOI: 10.3998/ark.5550190.0002.c05) |
| Wiley ID |
1908671 |
