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(1R,2R,3S,5R)-3-O-Benzylpinanediol
SpectraBase Compound ID C0uFIw1pLzB
InChI InChI=1S/C17H24O2/c1-16(2)13-9-14(16)17(3,18)15(10-13)19-11-12-7-5-4-6-8-12/h4-8,13-15,18H,9-11H2,1-3H3/t13-,14-,15+,17-/m1/s1
InChIKey SVZTYAIFTJHDIZ-PNBKFKSVSA-N
Mol Weight 260.38 g/mol
Molecular Formula C17H24O2
Exact Mass 260.17763 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D9m4wsRBTby
Name (1R,2R,3S,5R)-3-O-Benzylpinanediol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H24O2
InChI InChI=1S/C17H24O2/c1-16(2)13-9-14(16)17(3,18)15(10-13)19-11-12-7-5-4-6-8-12/h4-8,13-15,18H,9-11H2,1-3H3/t13-,14-,15+,17-/m1/s1
InChIKey SVZTYAIFTJHDIZ-PNBKFKSVSA-N
Molecular Weight 260.377 g/mol
SMILES O[C@@]1([C@]2(C(C)(C)[C@](C2)(C[C@@]1(OCc1ccccc1)[H])[H])[H])C
SPLASH splash10-0096-9400000000-df87a3677abb413217d9
Source of Spectrum QC-11-3499-2
Synonyms (1R,3S,4R,5R)-4,6,6-trimethyl-3-phenylmethoxy-4-bicyclo[3.1.1]heptanol (1R,3S,4R,5R)-4,6,6-trimethyl-3-phenylmethoxybicyclo[3.1.1]heptan-4-ol (1R,2R,3S,5R)-3-benzyloxy-2,6,6-trimethyl-norpinan-2-ol (1R,3S,4R,5R)-4,6,6-trimethyl-3-phenylmethoxy-bicyclo[3.1.1]heptan-4-ol
Wiley ID 860105