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(+)-(1S,2S,3S)-1-Chloro-1,3-diphenylheptane-2,3-diol
SpectraBase Compound ID LgSALTfgxz2
InChI InChI=1S/C19H23ClO2/c1-2-3-14-19(22,16-12-8-5-9-13-16)18(21)17(20)15-10-6-4-7-11-15/h4-13,17-18,21-22H,2-3,14H2,1H3/t17-,18+,19-/m0/s1
InChIKey HHCXNXMJVRJAQS-OTWHNJEPSA-N
Mol Weight 318.84 g/mol
Molecular Formula C19H23ClO2
Exact Mass 318.138658 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8q50QgPz5wC
Name (+)-(1S,2S,3S)-1-Chloro-1,3-diphenylheptane-2,3-diol
Alternate Name(s) (1S,2S,3S)-1-chloro-1,3-diphenyl-2,3-heptanediol
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Formula C19H23ClO2
InChI InChI=1S/C19H23ClO2/c1-2-3-14-19(22,16-12-8-5-9-13-16)18(21)17(20)15-10-6-4-7-11-15/h4-13,17-18,21-22H,2-3,14H2,1H3/t17-,18+,19-/m0/s1
InChIKey HHCXNXMJVRJAQS-OTWHNJEPSA-N
Molecular Weight 318.844 g/mol
SMILES O[C@]([C@@]([C@](c1ccccc1)(Cl)[H])(O)[H])(c1ccccc1)CCCC
SPLASH splash10-05fu-3900000000-86b08c6d52efd79b15cd
Source of Spectrum K-2001-1113-17
Wiley ID 1578893