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4-(Benzylidene)bicyclo[4.3.0]-2-oxanona-3-one
SpectraBase Compound ID D5PW2D1JoG6
InChI InChI=1S/C15H16O2/c16-15-13(10-11-6-2-1-3-7-11)12-8-4-5-9-14(12)17-15/h1-3,6-7,10,12,14H,4-5,8-9H2/b13-10+/t12-,14+/m0/s1
InChIKey NKQRCKBRNIYLNM-BILBVFMZSA-N
Mol Weight 228.29 g/mol
Molecular Formula C15H16O2
Exact Mass 228.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Lf6csbCJO9k
Name 4-(Benzylidene)bicyclo[4.3.0]-2-oxanona-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H16O2
InChI InChI=1S/C15H16O2/c16-15-13(10-11-6-2-1-3-7-11)12-8-4-5-9-14(12)17-15/h1-3,6-7,10,12,14H,4-5,8-9H2/b13-10+/t12-,14+/m0/s1
InChIKey NKQRCKBRNIYLNM-BILBVFMZSA-N
Molecular Weight 228.291 g/mol
SMILES C1(\C([C@]2([C@](O1)(CCCC2)[H])[H])=C\c1ccccc1)=O
SPLASH splash10-004l-3900000000-367003e13c4b5d553af1
Source of Spectrum J-57-4703-40
Synonyms (3aS,7aR)-3-[1-Phenyl-meth-(E)-ylidene]-hexahydro-benzofuran-2-one (4E)-4-benzylidenehexahydrocyclopenta[b]pyran-3(2H)-one 4-(Benzylidene)bicyclo[4.3.0]-2-oxanona-3-one isomer
Wiley ID 1230187