| SpectraBase Spectrum ID |
JYgEr0cvmGu |
| Name |
(3S,4R)-3-Isopropyl-7-methyl-4-(nitromethyl)chroman-2-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C14H17NO4 |
| InChI |
InChI=1S/C14H17NO4/c1-8(2)13-11(7-15(17)18)10-5-4-9(3)6-12(10)19-14(13)16/h4-6,8,11,13H,7H2,1-3H3/t11-,13-/m0/s1 |
| InChIKey |
CHTKEJHMWPHRRJ-AAEUAGOBSA-N |
| Literature Reference DOI |
10.1002/adsc.201000659 |
| Molecular Weight |
263.293 g/mol |
| SMILES |
C1(Oc2cc(ccc2[C@](C[N+](=O)[O-])([C@@]1(C(C)C)[H])[H])C)=O |
| SPLASH |
splash10-0h90-1950000000-2614e6d301a3e1722997 |
| Source of Spectrum |
ASC-352-2869/SM14-6j |
| Wiley ID |
1764156 |
