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1-((1R,3S)-5-methyl-1-(p-tolyl)-4-oxaspiro[2.5]octa-5,7-dien-6-yl)ethanone
SpectraBase Compound ID 3bp1fv5gh8W
InChI InChI=1S/C17H18O2/c1-11-4-6-14(7-5-11)16-10-17(16)9-8-15(12(2)18)13(3)19-17/h4-9,16H,10H2,1-3H3/t16-,17-/m1/s1
InChIKey LROVKZICTAGQOZ-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 xjthkCDmNl
Name 1-((1R,3S)-5-methyl-1-(p-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/c1-11-4-6-14(7-5-11)16-10-17(16)9-8-15(12(2)18)13(3)19-17/h4-9,16H,10H2,1-3H3/t16-,17-/m1/s1
InChIKey LROVKZICTAGQOZ-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@@](c2ccc(cc2)C)(C1)[H]
SPLASH splash10-00kf-6910000000-350aeda94ec2bd699840
Source of Spectrum A1-12-5120/SMS20-3d
Wiley ID 1752618