| SpectraBase Spectrum ID |
9Y1nfQiwqy7 |
| Name |
(3S,4R)-4-(Nitromethyl)-3-propylchroman-2-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H15NO4 |
| InChI |
InChI=1S/C13H15NO4/c1-2-5-10-11(8-14(16)17)9-6-3-4-7-12(9)18-13(10)15/h3-4,6-7,10-11H,2,5,8H2,1H3/t10-,11-/m0/s1 |
| InChIKey |
NHVJCRJANRUKRC-QWRGUYRKSA-N |
| Literature Reference DOI |
10.1002/adsc.201000659 |
| Molecular Weight |
249.266 g/mol |
| SMILES |
C1(Oc2ccccc2[C@@]([C@@]1(CCC)[H])(C[N+](=O)[O-])[H])=O |
| SPLASH |
splash10-03di-2910000000-a1ca1feccc6c7a674b3d |
| Source of Spectrum |
ASC-352-2869/SM12-6a |
| Wiley ID |
1764153 |
