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2-Oxa-3-((3'-(p-chlorobenzyloxy)-1',2'-hydroxy-propyl)-7-methoxy-1,3,4-trihydro-naphthalene-D3
SpectraBase Compound ID Hfq36Q0d03T
InChI InChI=1S/C20H23ClO5/c1-24-17-7-4-14-9-19(26-11-15(14)8-17)20(23)18(22)12-25-10-13-2-5-16(21)6-3-13/h2-8,18-20,22-23H,9-12H2,1H3/i1D3
InChIKey HSLZXEGRSPEMBS-FIBGUPNXSA-N
Mol Weight 381.87 g/mol
Molecular Formula C20H202D3ClO5
Exact Mass 381.142232 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ku1YyJct7pI
Name 2-Oxa-3-((3'-(p-chlorobenzyloxy)-1',2'-hydroxy-propyl)-7-methoxy-1,3,4-trihydro-naphthalene-D3
CAS Registry Number 114738-27-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H20D3ClO5
InChI InChI=1S/C20H23ClO5/c1-24-17-7-4-14-9-19(26-11-15(14)8-17)20(23)18(22)12-25-10-13-2-5-16(21)6-3-13/h2-8,18-20,22-23H,9-12H2,1H3/i1D3
InChIKey HSLZXEGRSPEMBS-FIBGUPNXSA-N
Molecular Weight 381.870 g/mol
SMILES OC(C(C1OCc2c(C1)ccc(OC([2D])([2D])[2D])c2)O)COCc1ccc(cc1)Cl
SPLASH splash10-002r-0900000000-59f5ee8cfb81605f484b
Source of Spectrum J-53-3292-7
Synonyms 2-Oxa-1,3,4-trihydro-4-deutero-3-(3'-(p-chlorophenyl-dideuteromethoxy)-1,2-dihydroxy-propyl)-5-methoxy-naphthalene
Wiley ID 1358703