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2(3H)-Benzofuranone, 6-ethenylhexahydro-3,6-dimethyl-5-(1-methylethenyl)-, [3R-(3.alpha.,3a.alpha.,5.beta.,6.alpha.,7a.alpha.)]-

View entire compound with spectra: 4 MS (GC)

2(3H)-Benzofuranone, 6-ethenylhexahydro-3,6-dimethyl-5-(1-methylethenyl)-, [3R-(3.alpha.,3a.alpha.,5.beta.,6.alpha.,7a.alpha.)]-
SpectraBase Compound ID 21F9HqnpK1n
InChI InChI=1S/C15H22O2/c1-6-15(5)8-13-11(7-12(15)9(2)3)10(4)14(16)17-13/h6,10-13H,1-2,7-8H2,3-5H3/t10-,11-,12+,13-,15-/m0/s1
InChIKey HHMGIPSZHRMYCD-AIUMHDJVSA-N
Mol Weight 234.34 g/mol
Molecular Formula C15H22O2
Exact Mass 234.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Khp7qRl50ph
Name 2(3H)-Benzofuranone, 6-ethenylhexahydro-3,6-dimethyl-5-(1-methylethenyl)-, [3R-(3.alpha.,3a.alpha.,5.beta.,6.alpha.,7a.alpha.)]-
Alternate Name(s) 5,7.alpha.H,8,11.beta.H-elema-1,3-dien-8,12-olide (3S,3aS,5R,6R,7aS)-5-isopropenyl-3,6-dimethyl-6-vinylhexahydro-1-benzofuran-2(3H)-one 6-Ethenyl-3,6-dimethyl-5-(1-methylethenyl)hexahydrobenzofuran-2(3H)-E t-(4,7)-E-(7,8)-8-ethenyl-4,8-dimethyl-7-propen-2'-yl-2-oxabicyclo[4.3.0]non-3-one Epicallitrin
CAS Registry Number 73335-81-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H22O2
InChI InChI=1S/C15H22O2/c1-6-15(5)8-13-11(7-12(15)9(2)3)10(4)14(16)17-13/h6,10-13H,1-2,7-8H2,3-5H3/t10-,11-,12+,13-,15-/m0/s1
InChIKey HHMGIPSZHRMYCD-AIUMHDJVSA-N
Molecular Weight 234.339 g/mol
SMILES C1(O[C@]2(C[C@@](C=C)(C)[C@](C[C@]2([C@@]1(C)[H])[H])(C(=C)C)[H])[H])=O
SPLASH splash10-03di-0940000000-13a954422d2bf5a9b12c
Source of Spectrum F-45-5933-13
Wiley ID 1236401