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[(1S,2R)-1-(cyclohexen-1-yl)-2-methyl-3-phenylmethoxy-propyl]sulfanylbenzene
SpectraBase Compound ID HtiVq1RYEKA
InChI InChI=1S/C23H28OS/c1-19(17-24-18-20-11-5-2-6-12-20)23(21-13-7-3-8-14-21)25-22-15-9-4-10-16-22/h2,4-6,9-13,15-16,19,23H,3,7-8,14,17-18H2,1H3/t19-,23+/m1/s1
InChIKey QCPBJXMKLUXWCK-XXBNENTESA-N
Mol Weight 352.54 g/mol
Molecular Formula C23H28OS
Exact Mass 352.186087 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Bx8Spb3JAIM
Name [(1S,2R)-1-(cyclohexen-1-yl)-2-methyl-3-phenylmethoxy-propyl]sulfanylbenzene
Alternate Name(s) [(1S,2R)-3-benzyloxy-1-(cyclohexen-1-yl)-2-methyl-propyl]sulfanylbenzene [[(1S,2R)-1-(1-cyclohexenyl)-2-methyl-3-phenylmethoxypropyl]thio]benzene [[(1S,2R)-3-benzoxy-1-(cyclohexen-1-yl)-2-methyl-propyl]thio]benzene
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Formula C23H28OS
InChI InChI=1S/C23H28OS/c1-19(17-24-18-20-11-5-2-6-12-20)23(21-13-7-3-8-14-21)25-22-15-9-4-10-16-22/h2,4-6,9-13,15-16,19,23H,3,7-8,14,17-18H2,1H3/t19-,23+/m1/s1
InChIKey QCPBJXMKLUXWCK-XXBNENTESA-N
Molecular Weight 352.536 g/mol
SMILES [C@@](C1=CCCCC1)(Sc1ccccc1)([C@@](COCc1ccccc1)(C)[H])[H]
SPLASH splash10-0006-9002000000-939a5a6ac65c4c2b2c03
Source of Spectrum KC-0-367-10
Wiley ID 785061