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TELEKIN,5-DESOXY,5-HYDROPEROXY

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TELEKIN,5-DESOXY,5-HYDROPEROXY
SpectraBase Compound ID 8Hse0dlUj2C
InChI InChI=1S/C15H20O4/c1-9-5-4-6-14(3)8-12-11(7-15(9,14)19-17)10(2)13(16)18-12/h11-12,17H,1-2,4-8H2,3H3/t11-,12-,14-,15-/m1/s1
InChIKey QPXUPGOUAFWPOB-QHSBEEBCSA-N
Mol Weight 264.32 g/mol
Molecular Formula C15H20O4
Exact Mass 264.136159 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3NgUS90D8jw
Name (3aR,4aR,8aR,9aR)-4a-(dioxidanyl)-8a-methyl-3,5-dimethylidene-4,6,7,8,9,9a-hexahydro-3aH-benzo[f][1]benzofuran-2-one
CAS Registry Number 89900-44-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H20O4
InChI InChI=1S/C15H20O4/c1-9-5-4-6-14(3)8-12-11(7-15(9,14)19-17)10(2)13(16)18-12/h11-12,17H,1-2,4-8H2,3H3/t11-,12-,14-,15-/m1/s1
InChIKey QPXUPGOUAFWPOB-QHSBEEBCSA-N
Molecular Weight 264.321 g/mol
SMILES OO[C@@]12[C@@](C[C@]3(OC(C([C@]3(C2)[H])=C)=O)[H])(CCCC1=C)C
SPLASH splash10-0a4j-9000000000-9155992adb61b101b233
Source of Spectrum F-43-2532-2
Synonyms (3aR,4aR,8aR,9aR)-4a-hydroperoxy-8a-methyl-3,5-dimethylene-4,6,7,8,9,9a-hexahydro-3aH-benzo[f]benzofuran-2-one (3aR,4aR,8aR,9aR)-4a-hydroperoxy-8a-methyl-3,5-dimethylidene-4,6,7,8,9,9a-hexahydro-3aH-benzo[f][1]benzofuran-2-one
Wiley ID 1267981