| SpectraBase Spectrum ID |
79I82gjNjRv |
| Name |
1,4-Methano-2H-3-benzoxocin-2-one, 5-bromo-1,4,5,6-tetrahydro-4,5-dimethyl-8-nitro-, (1.alpha.,4.alpha.,5.beta.)- |
| Alternate Name(s) |
(1S,9R,10R)-9-bromo-9,10-dimethyl-5-nitro-11-oxatricyclo[8.2.1.0(2,7)]trideca-2,4,6-trien-12-one
8-Bromo-7-hydroxy-7,8-dimethyl-2-nitro-6,7,8,9-tetrahydro-5H-benzocyclohepten-5-carboxylic acid-lactone |
| CAS Registry Number |
72410-76-5 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C14H14BrNO4 |
| InChI |
InChI=1S/C14H14BrNO4/c1-13(15)6-8-5-9(16(18)19)3-4-10(8)11-7-14(13,2)20-12(11)17/h3-5,11H,6-7H2,1-2H3/t11-,13+,14+/m0/s1 |
| InChIKey |
VROVTAPLAKVLOP-IACUBPJLSA-N |
| Molecular Weight |
340.173 g/mol |
| SMILES |
[C@@]12(OC(=O)[C@@](C2)(c2ccc(N(=O)=O)cc2C[C@]1(Br)C)[H])C |
| SPLASH |
splash10-02mi-0590000000-ceb6f38b1c6f97739a17 |
| Source of Spectrum |
K-112-3268-0 |
| Wiley ID |
1334318 |
