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(1R,2S,3R)-1-Benzoyloxy-5-hydroxy-2,3-isopropylidenedioxy-1-phenylpentane
SpectraBase Compound ID 38MIo0GqEu3
InChI InChI=1S/C21H24O5/c1-21(2)25-17(13-14-22)19(26-21)18(15-9-5-3-6-10-15)24-20(23)16-11-7-4-8-12-16/h3-12,17-19,22H,13-14H2,1-2H3/t17-,18-,19+/m1/s1
InChIKey YXGDKDFDTUNDFG-QRVBRYPASA-N
Mol Weight 356.42 g/mol
Molecular Formula C21H24O5
Exact Mass 356.162374 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8Mq8LNVAyQL
Name (1R,2S,3R)-1-Benzoyloxy-5-hydroxy-2,3-isopropylidenedioxy-1-phenylpentane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H24O5
InChI InChI=1S/C21H24O5/c1-21(2)25-17(13-14-22)19(26-21)18(15-9-5-3-6-10-15)24-20(23)16-11-7-4-8-12-16/h3-12,17-19,22H,13-14H2,1-2H3/t17-,18-,19+/m1/s1
InChIKey YXGDKDFDTUNDFG-QRVBRYPASA-N
Molecular Weight 356.418 g/mol
SMILES OCC[C@]1(OC(O[C@@]1([C@](OC(=O)c1ccccc1)(c1ccccc1)[H])[H])(C)C)[H]
SPLASH splash10-014i-0901000000-1baab44109db1869e4bc
Source of Spectrum KC-0-916-10
Synonyms (1R)-1-O-benzoyl-4-deoxy-2,3-O-(1-methylethylidene)-1-C-phenyl-D-threo-pentitol benzoic acid[(R)-[(4S,5R)-5-(2-hydroxyethyl)-2,2-dimethyl-1,3-dioxolan-4-yl]-phenyl-methyl]ester [(R)-[(4S,5R)-5-(2-hydroxyethyl)-2,2-dimethyl-1,3-dioxolan-4-yl]-phenyl-methyl]benzoate benzoic acid [(R)-[(4S,5R)-5-(2-hydroxyethyl)-2,2-dimethyl-1,3-dioxolan-4-yl]-phenylmethyl] ester [(R)-[(4S,5R)-5-(2-hydroxyethyl)-2,2-dimethyl-1,3-dioxolan-4-yl]-phenylmethyl] benzoate [(R)-[(4S,5R)-5-(2-hydroxyethyl)-2,2-dimethyl-1,3-dioxolan-4-yl]-phenyl-methyl] benzoate
Wiley ID 787736