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2-Benzothiazoleethanol, .alpha.,.beta.-diphenyl-, (R*,S*)-(.+-.)-
SpectraBase Compound ID LHxrCaf79Vs
InChI InChI=1S/C21H17NOS/c23-20(16-11-5-2-6-12-16)19(15-9-3-1-4-10-15)21-22-17-13-7-8-14-18(17)24-21/h1-14,19-20,23H/t19-,20-/m0/s1
InChIKey DCKOABSQLLRRDC-PMACEKPBSA-N
Mol Weight 331.43 g/mol
Molecular Formula C21H17NOS
Exact Mass 331.103085 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7tS23o1zoHk
Name 2-Benzothiazoleethanol, .alpha.,.beta.-diphenyl-, (R*,S*)-(.+-.)-
CAS Registry Number 100094-28-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H17NOS
InChI InChI=1S/C21H17NOS/c23-20(16-11-5-2-6-12-16)19(15-9-3-1-4-10-15)21-22-17-13-7-8-14-18(17)24-21/h1-14,19-20,23H/t19-,20-/m0/s1
InChIKey DCKOABSQLLRRDC-PMACEKPBSA-N
Molecular Weight 331.433 g/mol
SMILES O[C@]([C@@](c1nc2ccccc2s1)(c1ccccc1)[H])(c1ccccc1)[H]
SPLASH splash10-00b9-0290000000-317136d866413f210638
Source of Spectrum K-118-4274-7
Synonyms (1R,2S)-2-(1,3-benzothiazol-2-yl)-1,2-diphenylethanol (RS)(SR)-.alpha..beta.-diphenyl-2-benzothiazolethanol
Wiley ID 1328844