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(1S,2E,4S,8R,11S,12S,13S)-8,11,12,13-Diepoxy-4-hydroxy-2-cembren-6-one
SpectraBase Compound ID 6cKnbafEqcT
InChI InChI=1S/C20H32O4/c1-13(2)14-6-8-18(3,22)11-15(21)12-19(4)9-7-16(23-19)20(5)17(10-14)24-20/h6,8,13-14,16-17,22H,7,9-12H2,1-5H3/b8-6+/t14-,16-,17-,18+,19+,20+/m0/s1
InChIKey SRLFHHXUXZVPML-KFRRFUCJSA-N
Mol Weight 336.5 g/mol
Molecular Formula C20H32O4
Exact Mass 336.23006 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D1qyD6EnXDv
Name (1S,2E,4S,8R,11S,12S,13S)-8,11,12,13-Diepoxy-4-hydroxy-2-cembren-6-one
CAS Registry Number 98064-79-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H32O4
InChI InChI=1S/C20H32O4/c1-13(2)14-6-8-18(3,22)11-15(21)12-19(4)9-7-16(23-19)20(5)17(10-14)24-20/h6,8,13-14,16-17,22H,7,9-12H2,1-5H3/b8-6+/t14-,16-,17-,18+,19+,20+/m0/s1
InChIKey SRLFHHXUXZVPML-KFRRFUCJSA-N
Molecular Weight 336.472 g/mol
SMILES O[C@@]1(\C=C\[C@@](C[C@]2([C@](O2)([C@]2(O[C@](CC(C1)=O)(C)CC2)[H])C)[H])(C(C)C)[H])C
SPLASH splash10-0006-9300000000-d636d35d16a69625126a
Source of Spectrum J-50-4537-14
Synonyms (1S,2S,4S,6S,9S,13R)-9-hydroxy-6-isopropyl-2,9,13-trimethyl-3,16-dioxatricyclo[11.2.1.0(2,4)]hexadec-7-en-11-one
Wiley ID 1332564