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(2R,3R,4S,5S,6R,8S,10S)-10-benzyloxy-8-benzyloxymethyl-5-chloro-2-isopropyl-3-methyl-1,7-dioxaspiro[5.5]undecan-4-ol
SpectraBase Compound ID DwRiDPVrmYX
InChI InChI=1S/C28H37ClO5/c1-19(2)26-20(3)25(30)27(29)28(34-26)15-23(32-17-22-12-8-5-9-13-22)14-24(33-28)18-31-16-21-10-6-4-7-11-21/h4-13,19-20,23-27,30H,14-18H2,1-3H3/t20-,23+,24+,25+,26-,27+,28+/m1/s1
InChIKey JCVVGBMKZOHHOL-RVPAWSOTSA-N
Mol Weight 489.1 g/mol
Molecular Formula C28H37ClO5
Exact Mass 488.232952 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Joe1Y770wma
Name (2R,3R,4S,5S,6R,8S,10S)-10-benzyloxy-8-benzyloxymethyl-5-chloro-2-isopropyl-3-methyl-1,7-dioxaspiro[5.5]undecan-4-ol
Alternate Name(s) (2R,3R,4S,5S,6R,8S,10S)-10-(benzyloxy)-8-[(benzyloxy)methyl]-5-chloro-3-methyl-2-(propan-2-yl)-1,7-dioxaspiro[5.5]undecan-4-ol
CAS Registry Number 97848-45-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H37ClO5
InChI InChI=1S/C28H37ClO5/c1-19(2)26-20(3)25(30)27(29)28(34-26)15-23(32-17-22-12-8-5-9-13-22)14-24(33-28)18-31-16-21-10-6-4-7-11-21/h4-13,19-20,23-27,30H,14-18H2,1-3H3/t20-,23+,24+,25+,26-,27+,28+/m1/s1
InChIKey JCVVGBMKZOHHOL-RVPAWSOTSA-N
Molecular Weight 489.052 g/mol
SMILES O[C@]1([C@@](C)([C@](O[C@@]2([C@]1(Cl)[H])O[C@](COCc1ccccc1)(C[C@@](C2)(OCc1ccccc1)[H])[H])(C(C)C)[H])[H])[H]
SPLASH splash10-0006-9210000000-f2b1c249549e9a2bd571
Source of Spectrum KC-1988-94-34
Wiley ID 1396913