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4-Oxatricyclo[3.2.1.0(2,7)]octan-3-one, 6-(2-phenylethenyl)-, stereoisomer
SpectraBase Compound ID A4IX0J1jBMn
InChI InChI=1S/C15H14O2/c16-15-14-11-8-12(17-15)10(13(11)14)7-6-9-4-2-1-3-5-9/h1-7,10-14H,8H2/b7-6+
InChIKey AIFDHVXEYDSCGI-VOTSOKGWSA-N
Mol Weight 226.27 g/mol
Molecular Formula C15H14O2
Exact Mass 226.09938 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JNFBfabDX1j
Name 4-Oxatricyclo[3.2.1.0(2,7)]octan-3-one, 6-(2-phenylethenyl)-, stereoisomer
Alternate Name(s) 6-Carboxy-3-hydroxy-2-.beta.-phenylethylbicyclo[3.1.0]hexane .delta.-lactone 6-[(E)-2-phenylethenyl]-4-oxatricyclo[3.2.1.0(2,7)]octan-3-one
CAS Registry Number 57803-35-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H14O2
InChI InChI=1S/C15H14O2/c16-15-14-11-8-12(17-15)10(13(11)14)7-6-9-4-2-1-3-5-9/h1-7,10-14H,8H2/b7-6+
InChIKey AIFDHVXEYDSCGI-VOTSOKGWSA-N
Molecular Weight 226.275 g/mol
SMILES C12C3CC(OC2=O)C(C13)\C=C\c1ccccc1
SPLASH splash10-066u-3910000000-da5b3ba641d2f2ad724d
Source of Spectrum AN-84-828-0
Wiley ID 1227993