| SpectraBase Spectrum ID |
Kpyr2AWqLKj |
| Name |
(3S,4R)-3-Isopropyl-4-(nitromethyl)chroman-2-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H15NO4 |
| InChI |
InChI=1S/C13H15NO4/c1-8(2)12-10(7-14(16)17)9-5-3-4-6-11(9)18-13(12)15/h3-6,8,10,12H,7H2,1-2H3/t10-,12-/m0/s1 |
| InChIKey |
KTFYBGQWFULPLH-JQWIXIFHSA-N |
| Literature Reference DOI |
10.1002/adsc.201000659 |
| Molecular Weight |
249.266 g/mol |
| SMILES |
C1(Oc2ccccc2[C@](C[N+](=O)[O-])([C@@]1(C(C)C)[H])[H])=O |
| SPLASH |
splash10-03di-2910000000-3a1fe378f38d4d2f11aa |
| Source of Spectrum |
ASC-352-2869/SM13-6f |
| Wiley ID |
1764154 |
