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(3R)-3,4-dihydro-3-[(1R,2R)-1,2-dihydroxy-3-[(4-chlorobenzyl)oxy]propyl]-7-methoxy-1H-2-benzopyran
SpectraBase Compound ID IAZYz9Qw2LL
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/t18-,19-,20-/m1/s1
InChIKey HSLZXEGRSPEMBS-VAMGGRTRSA-N
Mol Weight 378.85 g/mol
Molecular Formula C20H23ClO5
Exact Mass 378.123402 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 88NHmMtldwE
Name (3R)-3,4-dihydro-3-[(1R,2R)-1,2-dihydroxy-3-[(4-chlorobenzyl)oxy]propyl]-7-methoxy-1H-2-benzopyran
Alternate Name(s) (1R,2R)-3-[(4-chlorobenzyl)oxy]-1-[(3R)-7-methoxy-3,4-dihydro-1H-2-benzopyran-3-yl]-1,2-propanediol
CAS Registry Number 114738-10-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H23ClO5
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/t18-,19-,20-/m1/s1
InChIKey HSLZXEGRSPEMBS-VAMGGRTRSA-N
Molecular Weight 378.852 g/mol
SMILES O[C@@]([C@]([C@@]1(OCc2c(C1)ccc(OC)c2)[H])(O)[H])(COCc1ccc(cc1)Cl)[H]
SPLASH splash10-004u-0900000000-8eb9963e63fcc0001fec
Source of Spectrum J-53-3290-7
Wiley ID 1358700