SpectraBase Spectrum ID |
36SMpK1ALbx |
Name |
rel-(1R,5R,7R)-Methyl 2-dicyanomethylidene-8-oxabicyclo[3.2.1]octane-7-carboxylate |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C12H12N2O3 |
InChI |
InChI=1S/C12H12N2O3/c1-16-12(15)10-4-8-2-3-9(11(10)17-8)7(5-13)6-14/h8,10-11H,2-4H2,1H3/t8-,10-,11+/m1/s1 |
InChIKey |
CDXUPKDCKJDCTH-IEBDPFPHSA-N |
Molecular Weight |
232.239 g/mol |
SMILES |
[C@]12([C@](C(=O)OC)(C[C@](O2)(CCC1=C(C#N)C#N)[H])[H])[H] |
SPLASH |
splash10-0h3u-0970000000-48745cd46efd0fb982be |
Source of Spectrum |
H1-51-2154-17 |
Synonyms |
Methyl (1R,5R,6R)-4-(dicyanomethylene)-8-oxabicyclo[3.2.1]octane-6-carboxylate |
Wiley ID |
817259 |