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Spiro[2H-1-benzopyran-2,2'-bicyclo[3.1.1]heptane]-6,8-dimethanol, 3,4-dihydro-5,7-dimethoxy-6',6'-dimethyl-4-(2-methylpropyl)-, [1'R-[1'.alpha.,2'.alpha.(S*),5'.alpha.]]-
SpectraBase Compound ID 4vil4laP7Fe
InChI InChI=1S/C25H38O5/c1-14(2)9-15-11-25(8-7-16-10-19(25)24(16,3)4)30-23-18(13-27)21(28-5)17(12-26)22(29-6)20(15)23/h14-16,19,26-27H,7-13H2,1-6H3/t15?,16-,19-,25+/m1/s1
InChIKey IVWKSAXWCWMNLQ-VOYLNKOKSA-N
Mol Weight 418.6 g/mol
Molecular Formula C25H38O5
Exact Mass 418.271924 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2qzWUJB9l1C
Name Spiro[2H-1-benzopyran-2,2'-bicyclo[3.1.1]heptane]-6,8-dimethanol, 3,4-dihydro-5,7-dimethoxy-6',6'-dimethyl-4-(2-methylpropyl)-, [1'R-[1'.alpha.,2'.alpha.(S*),5'.alpha.]]-
CAS Registry Number 115463-53-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H38O5
InChI InChI=1S/C25H38O5/c1-14(2)9-15-11-25(8-7-16-10-19(25)24(16,3)4)30-23-18(13-27)21(28-5)17(12-26)22(29-6)20(15)23/h14-16,19,26-27H,7-13H2,1-6H3/t15?,16-,19-,25+/m1/s1
InChIKey IVWKSAXWCWMNLQ-VOYLNKOKSA-N
Molecular Weight 418.574 g/mol
SMILES OCc1c(c(CO)c(c2c1O[C@@]1(CC2CC(C)C)[C@]2(C(C)(C)[C@@](CC1)([H])C2)[H])OC)OC
SPLASH splash10-014i-9142000000-b8e6f3d179b3c6b7572c
Source of Spectrum J-54-1568-10
Synonyms Spiro[2H-1-benzopyran-2,2'-bicyclo[3.1.1]heptane]-6,8-dimethanol, 3,4-dihydro-5,7-dimethoxy-6',6'-dimethyl-4-(2-methylpropyl)-, [1'R-[1'.alpha.,2'.beta.(S*),5'.alpha.]]- (1'R,2S,5'R)-6-(hydroxymethyl)-5,7-dimethoxy-6',6'-dimethyl-4-(2-methylpropyl)-3,4-dihydrospiro[1-benzopyran-2,2'-bicyclo[3.1.1]heptane]-8-ylmethanol
Wiley ID 1377329