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(2.beta.,3.beta.,3a.beta.,7a.beta.)-(+-)-3a,4,5,7a,3',4',5',6'-octahydro-3-hydroxyspiro[benzofuran-2-(3H),2'-[2H]pyran]
SpectraBase Compound ID 1CX88ddbz1I
InChI InChI=1S/C12H18O3/c13-11-9-5-1-2-6-10(9)15-12(11)7-3-4-8-14-12/h2,6,9-11,13H,1,3-5,7-8H2/t9-,10+,11+,12+/m0/s1
InChIKey YAFRBYJUJMEULA-IRCOFANPSA-N
Mol Weight 210.27 g/mol
Molecular Formula C12H18O3
Exact Mass 210.125594 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BAlfWo0ZcWw
Name (2.beta.,3.beta.,3a.beta.,7a.beta.)-(+-)-3a,4,5,7a,3',4',5',6'-octahydro-3-hydroxyspiro[benzofuran-2-(3H),2'-[2H]pyran]
Alternate Name(s) Spiro[benzofuran-2(3H),2'-[2H]pyran]-3-ol, 3',3a,4,4',5,5',6',7a-octahydro-, (2.alpha.,3.beta.,3a.beta.,7a.beta.)-(.+-.)- (2.alpha.,3.beta.,3a.beta.,7a.beta.)-(+-)-3a,4,5,7a,3',4',5',6'-octahydro-3-hydroxyspiro[benzofuran-2-(3H),2'-[2H]pyran] (2R,3R,3aR,7aR)-3a,4,5,7a-tetrahydro-3H-spiro[1-benzofuran-2,2'-oxane]-3-ol
CAS Registry Number 95340-82-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18O3
InChI InChI=1S/C12H18O3/c13-11-9-5-1-2-6-10(9)15-12(11)7-3-4-8-14-12/h2,6,9-11,13H,1,3-5,7-8H2/t9-,10+,11+,12+/m0/s1
InChIKey YAFRBYJUJMEULA-IRCOFANPSA-N
Molecular Weight 210.273 g/mol
SMILES O[C@]1([C@@]2(O[C@@]3(C=CCC[C@]13[H])[H])OCCCC2)[H]
SPLASH splash10-0ufr-2900000000-045ae5297124fd90dfc6
Source of Spectrum J-50-1116-7
Wiley ID 1209244