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EUDESM-4-EN-12,8-beta-OLIDE,11-beta-PHENYLSELENO
SpectraBase Compound ID KszQHGTZYwS
InChI InChI=1S/C21H26O2Se/c1-14-8-7-11-20(2)13-18-17(12-16(14)20)21(3,19(22)23-18)24-15-9-5-4-6-10-15/h4-6,9-10,17-18H,7-8,11-13H2,1-3H3/t17-,18+,20+,21-/m0/s1
InChIKey XTYYLHFSWJTZHS-ZSXPUABSSA-N
Mol Weight 389.41 g/mol
Molecular Formula C21H26O2Se
Exact Mass 390.109802 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CTo1iNvW6p5
Name Naphtho[2,3-b]furan-2(3H)-one, 3a,4,6,7,8,8a,9,9a-octahydro-3,5,8a-trimethyl-3-(phenylseleno)-, [3S-(3.alpha.,3a.beta.,8a.alpha.,9a.bet a.)]-
CAS Registry Number 113306-92-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H26O2Se
InChI InChI=1S/C21H26O2Se/c1-14-8-7-11-20(2)13-18-17(12-16(14)20)21(3,19(22)23-18)24-15-9-5-4-6-10-15/h4-6,9-10,17-18H,7-8,11-13H2,1-3H3/t17-,18+,20+,21-/m0/s1
InChIKey XTYYLHFSWJTZHS-ZSXPUABSSA-N
Molecular Weight 389.409 g/mol
SMILES [C@]1([C@@]2([C@](C[C@@]3(C(C2)=C(CCC3)C)C)([H])OC1=O)[H])([Se]c1ccccc1)C
SPLASH splash10-0006-9441000000-2c35f5ce9818b9b3f443
Source of Spectrum F-43-2531-28
Synonyms (3S,3aS,8aR,9aR)-3,5,8a-trimethyl-3-(phenylselanyl)-3a,4,6,7,8,8a,9,9a-octahydronaphtho[2,3-b]furan-2(3H)-one 11.beta.-phenylseleno-7,8.alpha.H-eudesm-4-en-12,8-olide
Wiley ID 1364776