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1,7-Dioxaspiro[4.4]nonane-2,6-dione, 8-(1,2-dihydroxyethyl)-4-(3,4-dimethoxyphenyl)-9-hydroxy-, [5S-[5.alpha.(S*),8.alpha.(R*),9.beta.]]-

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1,7-Dioxaspiro[4.4]nonane-2,6-dione, 8-(1,2-dihydroxyethyl)-4-(3,4-dimethoxyphenyl)-9-hydroxy-, [5S-[5.alpha.(S*),8.alpha.(R*),9.beta.]]-
SpectraBase Compound ID D1Nd9TV56aj
InChI InChI=1S/C17H20O9/c1-23-11-4-3-8(5-12(11)24-2)9-6-13(20)26-17(9)15(21)14(10(19)7-18)25-16(17)22/h3-5,9-10,14-15,18-19,21H,6-7H2,1-2H3/t9?,10?,14-,15-,17+/m1/s1
InChIKey CCYPWRASXBZHGX-QZDBOOBNSA-N
Mol Weight 368.34 g/mol
Molecular Formula C17H20O9
Exact Mass 368.110732 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 97hKHLVwBvW
Name 1,7-Dioxaspiro[4.4]nonane-2,6-dione, 8-(1,2-dihydroxyethyl)-4-(3,4-dimethoxyphenyl)-9-hydroxy-, [5S-[5.alpha.(S*),8.alpha.(R*),9.beta.]]-
Alternate Name(s) (5S,8R,9R)-8-(1,2-dihydroxyethyl)-4-(3,4-dimethoxyphenyl)-9-hydroxy-1,7-dioxaspiro[4.4]nonane-2,6-dione 1,7-Dioxa-4-(3,4-dimethoxyphenyl)-9-hydroxy-8-)1,2-dihydroxyethyl)-spiro[4,4]nona-2,6-dione 3,6-Dioxa-5-hydroxy-4-(1,2-dihydroxyethyl)-9-(3,4-dimethoxyphenyl)-spiro[4.4]nona-2-one
CAS Registry Number 59873-50-6
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H20O9
InChI InChI=1S/C17H20O9/c1-23-11-4-3-8(5-12(11)24-2)9-6-13(20)26-17(9)15(21)14(10(19)7-18)25-16(17)22/h3-5,9-10,14-15,18-19,21H,6-7H2,1-2H3/t9?,10?,14-,15-,17+/m1/s1
InChIKey CCYPWRASXBZHGX-QZDBOOBNSA-N
Molecular Weight 368.338 g/mol
SMILES O[C@@]1([C@@](C(CO)O)(OC([C@]11C(c2cc(OC)c(cc2)OC)CC(O1)=O)=O)[H])[H]
SPLASH splash10-03xr-0906000000-926bfeea3e78a09a73aa
Source of Spectrum KC-1988-883-1
Wiley ID 1352848