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(3R,3aS,4S,6aS)-Tetrahydro-6a-(ethoxycarbonyl)-1-(phenylmethyl)-3,4-propano-1H,6H-furo[3,4-c]isoxazol-6-one
SpectraBase Compound ID HNPLgLeSFih
InChI InChI=1S/C18H21NO5/c1-2-22-16(20)18-15-13(23-17(18)21)9-6-10-14(15)24-19(18)11-12-7-4-3-5-8-12/h3-5,7-8,13-15H,2,6,9-11H2,1H3/t13-,14+,15-,18-/m0/s1
InChIKey GJXLLQSPRQJGCW-KRXQYRFLSA-N
Mol Weight 331.37 g/mol
Molecular Formula C18H21NO5
Exact Mass 331.141973 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IhsTPt8voFF
Name (3R,3aS,4S,6aS)-Tetrahydro-6a-(ethoxycarbonyl)-1-(phenylmethyl)-3,4-propano-1H,6H-furo[3,4-c]isoxazol-6-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H21NO5
InChI InChI=1S/C18H21NO5/c1-2-22-16(20)18-15-13(23-17(18)21)9-6-10-14(15)24-19(18)11-12-7-4-3-5-8-12/h3-5,7-8,13-15H,2,6,9-11H2,1H3/t13-,14+,15-,18-/m0/s1
InChIKey GJXLLQSPRQJGCW-KRXQYRFLSA-N
Molecular Weight 331.368 g/mol
SMILES [C@@]12(N(O[C@]3([C@@]2([C@@](CCC3)([H])OC1=O)[H])[H])Cc1ccccc1)C(=O)OCC
SPLASH splash10-0006-9033000000-ebe73281f9e1dfccbaf9
Source of Spectrum F-51-127-11
Synonyms (3R*,3aR*,4S*,6aS*)-Tetrahydro-6a-(ethoxycarbonyl)-1-(phenylmethyl)-3,4-propano-1H,6H-furo[3,4-c]isoxazol-6-one Ethyl (2aS,4aS,7aR,7bS)-2-benzyl-3-oxohexahydro-2H-furo[4,3,2-cd][1,2]benzisoxazole-2a(3H)-carboxylate
Wiley ID 790476