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5-Benzyl-3,7-dioxatricyclo[4.3.3.0(1,6)]dodecan-4-one
SpectraBase Compound ID JTFjGUSppuf
InChI InChI=1S/C17H20O3/c18-15-14(11-13-5-2-1-3-6-13)17-8-4-7-16(17,12-19-15)9-10-20-17/h1-3,5-6,14H,4,7-12H2/t14?,16-,17+/m1/s1
InChIKey XINRDSRNEPUMNH-XMKPYSNPSA-N
Mol Weight 272.34 g/mol
Molecular Formula C17H20O3
Exact Mass 272.141245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ff4z6Q4z3kh
Name 5-Benzyl-3,7-dioxatricyclo[4.3.3.0(1,6)]dodecan-4-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H20O3
InChI InChI=1S/C17H20O3/c18-15-14(11-13-5-2-1-3-6-13)17-8-4-7-16(17,12-19-15)9-10-20-17/h1-3,5-6,14H,4,7-12H2/t14?,16-,17+/m1/s1
InChIKey XINRDSRNEPUMNH-XMKPYSNPSA-N
Molecular Weight 272.344 g/mol
SMILES C1([C@]23[C@@](CCO3)(CCC2)COC1=O)Cc1ccccc1
SPLASH splash10-00di-0940000000-2e7cacae8d5c247f4c87
Source of Spectrum KC-1991-1554-22
Wiley ID 1276468