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3-Dodecanol, 2-(phenylsulfonyl)-, (R*,R*)-
SpectraBase Compound ID 2ZfAYeMx1sL
InChI InChI=1S/C18H30O3S/c1-3-4-5-6-7-8-12-15-18(19)16(2)22(20,21)17-13-10-9-11-14-17/h9-11,13-14,16,18-19H,3-8,12,15H2,1-2H3/t16-,18-/m1/s1
InChIKey MLKBVKYNBSIQNY-SJLPKXTDSA-N
Mol Weight 326.5 g/mol
Molecular Formula C18H30O3S
Exact Mass 326.191566 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7z9WicGuHqj
Name 3-Dodecanol, 2-(phenylsulfonyl)-, (R*,R*)-
CAS Registry Number 119181-46-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H30O3S
InChI InChI=1S/C18H30O3S/c1-3-4-5-6-7-8-12-15-18(19)16(2)22(20,21)17-13-10-9-11-14-17/h9-11,13-14,16,18-19H,3-8,12,15H2,1-2H3/t16-,18-/m1/s1
InChIKey MLKBVKYNBSIQNY-SJLPKXTDSA-N
Molecular Weight 326.495 g/mol
SMILES O[C@@]([C@](S(=O)(=O)c1ccccc1)(C)[H])(CCCCCCCCC)[H]
SPLASH splash10-00di-0900000000-657e7a3ff7328cd75cfc
Source of Spectrum KC-1988-2401-2
Synonyms (2R,3R)-2-(phenylsulfonyl)-3-dodecanol (erythro)-3-phenylsulphonyldodecan-2-ol
Wiley ID 1324789