| SpectraBase Spectrum ID |
DPmpXjhqK9L |
| Name |
trans-3-tert-butyl-4,5-dihydro-5-phenyl-4-isoxazolecarboxylic acid ethyl ester |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
275.152143537 u |
| Formula |
C16H21NO3 |
| InChI |
InChI=1S/C16H21NO3/c1-5-19-15(18)12-13(11-9-7-6-8-10-11)20-17-14(12)16(2,3)4/h6-10,12-13H,5H2,1-4H3/t12-,13-/m0/s1 |
| InChIKey |
YYJVIVRXXAMRST-STQMWFEESA-N |
| Instrument Name |
VG Micromass 7070F or AEI MS-30 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.3998/ark.5550190.0002.c05 |
| Molecular Weight |
275.348 g/mol |
| Quality |
78 |
| SMILES |
[C@]1([C@@](C(=NO1)C(C)(C)C)(C(OCC)=O)[H])(C1=CC=CC=C1)[H] |
| SPLASH |
splash10-0a4i-3900000000-162624cfd15915ab755e |
| Source of Spectrum |
ARK-2001-42-7d, (+ or -)-7d (DOI: 10.3998/ark.5550190.0002.c05) |
| Wiley ID |
1908673 |
