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3,exo-6-diphenyl-4-oxa-exo-tricyclo[6.2.1.0(2,7)]undec-2-en-5-one
SpectraBase Compound ID 19Jxsa9DNvN
InChI InChI=1S/C22H20O2/c23-22-20(14-7-3-1-4-8-14)18-16-11-12-17(13-16)19(18)21(24-22)15-9-5-2-6-10-15/h1-10,16-18,20H,11-13H2
InChIKey QUURMKHGYFPMLQ-UHFFFAOYSA-N
Mol Weight 316.4 g/mol
Molecular Formula C22H20O2
Exact Mass 316.14633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JdMreaW8ml9
Name 3,exo-6-diphenyl-4-oxa-exo-tricyclo[6.2.1.0(2,7)]undec-2-en-5-one
Alternate Name(s) 3,endo-6-diphenyl-4-oxa-exo-tricyclo[6.2.1.0(2,7)]undec-2-en-5-one 3,6-Diphenyl-4-oxatricyclo[6.2.1.0(2,7)]undec-2-en-5-one
CAS Registry Number 98463-87-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H20O2
InChI InChI=1S/C22H20O2/c23-22-20(14-7-3-1-4-8-14)18-16-11-12-17(13-16)19(18)21(24-22)15-9-5-2-6-10-15/h1-10,16-18,20H,11-13H2
InChIKey QUURMKHGYFPMLQ-UHFFFAOYSA-N
Molecular Weight 316.400 g/mol
SMILES C12=C(OC(C(C2C2CC1CC2)c1ccccc1)=O)c1ccccc1
SPLASH splash10-0aor-9400000000-7b4acdf3b015fb0da38b
Source of Spectrum K-118-2962-10
Wiley ID 1317354