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2-[(4R,5R)-4-(2-Hydroxyphenyl)-2,2-dimethyl-1,3-dioxolane-5-yl]phenyl (S)-1-methoxy-1-phenylacetate
SpectraBase Compound ID KeceHScNcjo
InChI InChI=1S/C26H26O6/c1-26(2)31-23(18-13-7-9-15-20(18)27)24(32-26)19-14-8-10-16-21(19)30-25(28)22(29-3)17-11-5-4-6-12-17/h4-16,22-24,27H,1-3H3/t22-,23+,24+/m0/s1
InChIKey AXEOFUPUARXTEH-RBZQAINGSA-N
Mol Weight 434.49 g/mol
Molecular Formula C26H26O6
Exact Mass 434.172939 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 88iiSFc7cJu
Name 2-[(4R,5R)-4-(2-Hydroxyphenyl)-2,2-dimethyl-1,3-dioxolane-5-yl]phenyl (S)-1-methoxy-1-phenylacetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H26O6
InChI InChI=1S/C26H26O6/c1-26(2)31-23(18-13-7-9-15-20(18)27)24(32-26)19-14-8-10-16-21(19)30-25(28)22(29-3)17-11-5-4-6-12-17/h4-16,22-24,27H,1-3H3/t22-,23+,24+/m0/s1
InChIKey AXEOFUPUARXTEH-RBZQAINGSA-N
Molecular Weight 434.488 g/mol
SMILES Oc1c([C@@]2([C@@](c3c(OC([C@](c4ccccc4)(OC)[H])=O)cccc3)(OC(C)(C)O2)[H])[H])cccc1
SPLASH splash10-03di-2913000000-fec9e02021175cb4d35f
Source of Spectrum QC-7-153-6
Synonyms 2-[(4R,5R)-5-(2-hydroxyphenyl)-2,2-dimethyl-1,3-dioxolan-4-yl]phenyl (2S)-methoxy(phenyl)ethanoate
Wiley ID 869118