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1-Naphthaleneacetic acid, 1,2,3,4,4a,7,8,8a-octahydro-3,4-dihydroxy-1,2,4a,5-tetramethyl-, [1R-(1.alpha.,2.beta.,3.alpha.,4.beta.,4a.bet a.,8a.alpha.)]-
SpectraBase Compound ID 80dS7Q7azRn
InChI InChI=1S/C16H26O4/c1-9-6-5-7-11-15(3,8-12(17)18)10(2)13(19)14(20)16(9,11)4/h6,10-11,13-14,19-20H,5,7-8H2,1-4H3,(H,17,18)/t10-,11-,13-,14+,15+,16+/m1/s1
InChIKey UYCCHEQGCWMLEE-QAKAVFCJSA-N
Mol Weight 282.38 g/mol
Molecular Formula C16H26O4
Exact Mass 282.183109 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BDQ9yMiBJ5p
Name 1-Naphthaleneacetic acid, 1,2,3,4,4a,7,8,8a-octahydro-3,4-dihydroxy-1,2,4a,5-tetramethyl-, [1R-(1.alpha.,2.beta.,3.alpha.,4.beta.,4a.bet a.,8a.alpha.)]-
CAS Registry Number 100324-77-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H26O4
InChI InChI=1S/C16H26O4/c1-9-6-5-7-11-15(3,8-12(17)18)10(2)13(19)14(20)16(9,11)4/h6,10-11,13-14,19-20H,5,7-8H2,1-4H3,(H,17,18)/t10-,11-,13-,14+,15+,16+/m1/s1
InChIKey UYCCHEQGCWMLEE-QAKAVFCJSA-N
Molecular Weight 282.380 g/mol
SMILES OC(C[C@@]1([C@@]2([C@@]([C@]([C@@]([C@]1(C)[H])(O)[H])(O)[H])(C(=CCC2)C)C)[H])C)=O
SPLASH splash10-0a5a-9010000000-117c8213096f534fa473
Source of Spectrum F-41-5356-15
Synonyms 6.alpha.,7.beta.-dihydroxy-nokolavenic acid [(1R,2S,3R,4R,4aR,8aR)-3,4-dihydroxy-1,2,4a,5-tetramethyl-1,2,3,4,4a,7,8,8a-octahydro-1-naphthalenyl]acetic acid
Wiley ID 1285961