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1-((1R,3S)-5-methyl-1-(m-tolyl)-4-oxaspiro[2.5]octa-5,7-dien-6-yl)ethanone
SpectraBase Compound ID 8eXTifvS9qu
InChI InChI=1S/C17H18O2/c1-11-5-4-6-14(9-11)16-10-17(16)8-7-15(12(2)18)13(3)19-17/h4-9,16H,10H2,1-3H3/t16-,17-/m1/s1
InChIKey BSRRRALLFMNJKI-IAGOWNOFSA-N
Mol Weight 254.33 g/mol
Molecular Formula C17H18O2
Exact Mass 254.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 43v4F3hH8T4
Name 1-((1R,3S)-5-methyl-1-(m-tolyl)-4-oxaspiro[2.5]octa-5,7-dien-6-yl)ethanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H18O2
InChI InChI=1S/C17H18O2/c1-11-5-4-6-14(9-11)16-10-17(16)8-7-15(12(2)18)13(3)19-17/h4-9,16H,10H2,1-3H3/t16-,17-/m1/s1
InChIKey BSRRRALLFMNJKI-IAGOWNOFSA-N
Literature Reference DOI 10.1021/ol102002f
Molecular Weight 254.329 g/mol
SMILES [C@@]12(OC(C)=C(C=C2)C(=O)C)[C@@](c2cccc(c2)C)(C1)[H]
SPLASH splash10-0udl-3390000000-c591dbb217742ea2c9c1
Source of Spectrum A1-12-5120/SMS27-3g
Wiley ID 1752621