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(4R)-4-Hydroxy-4-phenyl-2S,3S-o-isopropylidenebutyl benzyl ether

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

(4R)-4-Hydroxy-4-phenyl-2S,3S-o-isopropylidenebutyl benzyl ether
SpectraBase Compound ID L2BvF2ICtkQ
InChI InChI=1S/C20H24O4/c1-20(2)23-17(14-22-13-15-9-5-3-6-10-15)19(24-20)18(21)16-11-7-4-8-12-16/h3-12,17-19,21H,13-14H2,1-2H3/t17-,18-,19+/m1/s1
InChIKey GMKCPUXMHAQNQQ-QRVBRYPASA-N
Mol Weight 328.41 g/mol
Molecular Formula C20H24O4
Exact Mass 328.167459 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9IXahXkc22i
Name (4R)-4-Hydroxy-4-phenyl-2S,3S-o-isopropylidenebutyl benzyl ether
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 328.167459249 u
Formula C20H24O4
InChI InChI=1S/C20H24O4/c1-20(2)23-17(14-22-13-15-9-5-3-6-10-15)19(24-20)18(21)16-11-7-4-8-12-16/h3-12,17-19,21H,13-14H2,1-2H3/t17-,18-,19+/m1/s1
InChIKey GMKCPUXMHAQNQQ-QRVBRYPASA-N
Molecular Weight 328.408 g/mol
SMILES [C@]1(OC(C)(C)O[C@@]1(COCC1=CC=CC=C1)[H])([C@@](C1=CC=CC=C1)(O)[H])[H]