SpectraBase Spectrum ID |
4ntDJ40LvCl |
Name |
(3S,4R)-6-Bromo-3-(2-methylprop-1-en-1-yl)-4-(nitromethyl)chroman-2-one |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C14H14BrNO4 |
InChI |
InChI=1S/C14H14BrNO4/c1-8(2)5-11-12(7-16(18)19)10-6-9(15)3-4-13(10)20-14(11)17/h3-6,11-12H,7H2,1-2H3/t11-,12-/m0/s1 |
InChIKey |
DBFUJTXHGGGZQS-RYUDHWBXSA-N |
Literature Reference DOI |
10.1002/asia.201100320 |
Molecular Weight |
340.173 g/mol |
SMILES |
C1([C@]([C@](c2cc(ccc2O1)Br)(C[N+](=O)[O-])[H])(C=C(C)C)[H])=O |
SPLASH |
splash10-00y0-7921000000-201f09c8b1cf80ca7a9d |
Source of Spectrum |
CAJ-6-2255/SM7-7g |
Wiley ID |
1773087 |