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Iso-albassitriol
SpectraBase Compound ID JbJP0Bf0ZD7
InChI InChI=1S/C15H26O3/c1-12(2)7-5-8-13(3)11(12)6-9-14(4,17)15(13,18)10-16/h6,9,11,16-18H,5,7-8,10H2,1-4H3/t11-,13-,14-,15-/m0/s1
InChIKey FTSLIJCRICJJFO-MXAVVETBSA-N
Mol Weight 254.37 g/mol
Molecular Formula C15H26O3
Exact Mass 254.188195 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KhKRUN6Npli
Name Iso-albassitriol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H26O3
InChI InChI=1S/C15H26O3/c1-12(2)7-5-8-13(3)11(12)6-9-14(4,17)15(13,18)10-16/h6,9,11,16-18H,5,7-8,10H2,1-4H3/t11-,13-,14-,15-/m0/s1
InChIKey FTSLIJCRICJJFO-MXAVVETBSA-N
Molecular Weight 254.370 g/mol
SMILES O[C@]1(C=C[C@@]2([C@@]([C@]1(CO)O)(CCCC2(C)C)C)[H])C
SPLASH splash10-004i-0920000000-c941dbb08696dc800dc9
Source of Spectrum X2-50-416-9
Synonyms (1R,2S,4aS,8aS)-1-(hydroxymethyl)-2,5,5,8a-tetramethyl-1,2,4a,5,6,7,8,8a-octahydro-1,2-naphthalenediol 8.beta.,9.alpha.,11-Trihydroxy-drim-6-ene
Wiley ID 1602275