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(.alpha.'S and R,2R)-2-(5'-Benzyloxy-3'-chloro-2'-methoxy-.alpha.'-methylbenzyloxy)propanol
SpectraBase Compound ID CbXQgFIvDa7
InChI InChI=1S/C19H23ClO4/c1-13(11-21)24-14(2)17-9-16(10-18(20)19(17)22-3)23-12-15-7-5-4-6-8-15/h4-10,13-14,21H,11-12H2,1-3H3/t13-,14?/m1/s1
InChIKey PPGIBGNRNKTIMG-KWCCSABGSA-N
Mol Weight 350.84 g/mol
Molecular Formula C19H23ClO4
Exact Mass 350.128487 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GMLWXz0mmJL
Name (.alpha.'S and R,2R)-2-(5'-Benzyloxy-3'-chloro-2'-methoxy-.alpha.'-methylbenzyloxy)propanol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 350.128486917 u
Formula C19H23ClO4
InChI InChI=1S/C19H23ClO4/c1-13(11-21)24-14(2)17-9-16(10-18(20)19(17)22-3)23-12-15-7-5-4-6-8-15/h4-10,13-14,21H,11-12H2,1-3H3/t13-,14?/m1/s1
InChIKey PPGIBGNRNKTIMG-KWCCSABGSA-N
Instrument Name Hewlett Packard 5986
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0003.911
Molecular Weight 350.842 g/mol
Quality 41
SMILES OC[C@](OC(C=1C(=C(C=C(C1)OCC1=CC=CC=C1)Cl)OC)C)(C)[H]
SPLASH splash10-001i-0920000000-3af9bc8ff24b3d3e8f69
Sample Comments dr = 1:1
Source of Spectrum ARK-2002-115-34 (DOI: 10.3998/ark.5550190.0003.911)
Wiley ID 1904845