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5-Benzyl-3,12-dioxatricyclo[4.4.2.0(1,6)]dodecan-4-one
SpectraBase Compound ID HwNyXVdVtc3
InChI InChI=1S/C17H20O3/c18-15-14(10-13-6-2-1-3-7-13)17-9-5-4-8-16(17,11-19-15)12-20-17/h1-3,6-7,14H,4-5,8-12H2
InChIKey ZYTLGTPSZCJVDA-UHFFFAOYSA-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 KWxdBbqatzw
Name 5-Benzyl-3,12-dioxatricyclo[4.4.2.0(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(10-13-6-2-1-3-7-13)17-9-5-4-8-16(17,11-19-15)12-20-17/h1-3,6-7,14H,4-5,8-12H2
InChIKey ZYTLGTPSZCJVDA-UHFFFAOYSA-N
Molecular Weight 272.344 g/mol
SMILES C123C(C(=O)OCC3(CCCC1)CO2)Cc1ccccc1
SPLASH splash10-0006-9130000000-2310c1a3b23b9e22bdc4
Source of Spectrum KC-1991-1554-24
Wiley ID 1276469