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Benzenemethanol, .alpha.-(3-methoxy-3-phenyl-1-propynyl)-, (R*,S*)-(.+-.)-
SpectraBase Compound ID 56cX7Up76v7
InChI InChI=1S/C17H16O2/c1-19-17(15-10-6-3-7-11-15)13-12-16(18)14-8-4-2-5-9-14/h2-11,16-18H,1H3/t16-,17+/m1/s1
InChIKey KPHCOKUPRSIVAB-SJORKVTESA-N
Mol Weight 252.31 g/mol
Molecular Formula C17H16O2
Exact Mass 252.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID dEUQal8vA
Name Benzenemethanol, .alpha.-(3-methoxy-3-phenyl-1-propynyl)-, (R*,S*)-(.+-.)-
Alternate Name(s) (1S,4R)-4-methoxy-1,4-diphenyl-2-butyn-1-ol (RS,SR)-4-methoxy-1,4-diphenylbut-2-yn-1-ol
CAS Registry Number 107487-46-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H16O2
InChI InChI=1S/C17H16O2/c1-19-17(15-10-6-3-7-11-15)13-12-16(18)14-8-4-2-5-9-14/h2-11,16-18H,1H3/t16-,17+/m1/s1
InChIKey KPHCOKUPRSIVAB-SJORKVTESA-N
Molecular Weight 252.313 g/mol
SMILES O[C@](C#C[C@@](c1ccccc1)(OC)[H])(c1ccccc1)[H]
SPLASH splash10-0kdo-9720000000-ac267f88681f0b37cd0b
Source of Spectrum KC-1986-727-0
Wiley ID 1256261