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(2S,3S)-2-Benzyl-3-chloro-4-methyl-pentane-1,2-diol
SpectraBase Compound ID Ejz7ar7Pvh3
InChI InChI=1S/C13H19ClO2/c1-10(2)12(14)13(16,9-15)8-11-6-4-3-5-7-11/h3-7,10,12,15-16H,8-9H2,1-2H3/t12-,13-/m0/s1
InChIKey QEPZMANKHQEVJE-STQMWFEESA-N
Mol Weight 242.75 g/mol
Molecular Formula C13H19ClO2
Exact Mass 242.107358 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2eiGmxKKZ6E
Name (2S,3S)-2-Benzyl-3-chloro-4-methyl-pentane-1,2-diol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H19ClO2
InChI InChI=1S/C13H19ClO2/c1-10(2)12(14)13(16,9-15)8-11-6-4-3-5-7-11/h3-7,10,12,15-16H,8-9H2,1-2H3/t12-,13-/m0/s1
InChIKey QEPZMANKHQEVJE-STQMWFEESA-N
Molecular Weight 242.746 g/mol
SMILES O[C@@](CO)([C@@](Cl)(C(C)C)[H])Cc1ccccc1
SPLASH splash10-0006-9200000000-c5957618a5574ba54af8
Source of Spectrum F-52-10876-15
Synonyms (2RS,3SR)-2-Benzyl-3-chloro-4-methyl-1,2-pentanediol (2S,3S)-2-benzyl-3-chloro-4-methyl-1,2-pentanediol
Wiley ID 798073