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5,5,8a-Triimethyl-2-[2-(4-methylphenyl)ethenyl]-hexahydrobenzo[b]pyran-2,4a-peroxide
SpectraBase Compound ID LsiiSlSUorQ
InChI InChI=1S/C21H26O3/c1-16-6-8-17(9-7-16)10-13-20-14-15-21(24-23-20)18(2,3)11-5-12-19(21,4)22-20/h6-10,13-15H,5,11-12H2,1-4H3/b13-10+/t19-,20+,21+/m0/s1
InChIKey DSNVGDIREOFKND-GYECDMDRSA-N
Mol Weight 326.44 g/mol
Molecular Formula C21H26O3
Exact Mass 326.188195 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LJK8HllUdnd
Name 5,5,8a-Triimethyl-2-[2-(4-methylphenyl)ethenyl]-hexahydrobenzo[b]pyran-2,4a-peroxide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H26O3
InChI InChI=1S/C21H26O3/c1-16-6-8-17(9-7-16)10-13-20-14-15-21(24-23-20)18(2,3)11-5-12-19(21,4)22-20/h6-10,13-15H,5,11-12H2,1-4H3/b13-10+/t19-,20+,21+/m0/s1
InChIKey DSNVGDIREOFKND-GYECDMDRSA-N
Molecular Weight 326.436 g/mol
SMILES [C@]123[C@@](O[C@](C=C3)(\C=C\c3ccc(cc3)C)OO2)(CCCC1(C)C)C
SPLASH splash10-014i-8497000000-ac914fc8324ec906d730
Source of Spectrum O1-44-1945-6
Wiley ID 1621346