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(2R,3R,4aR,7R,12aS)-2,3-Dimethoxy-2,3,7-trimethyl-decahydro-1,4,6-trioxa-benzocyclodecen-5-one
SpectraBase Compound ID Gxufjlv7qT2
InChI InChI=1S/C16H28O6/c1-11-9-7-6-8-10-12-13(14(17)20-11)22-16(3,19-5)15(2,18-4)21-12/h11-13H,6-10H2,1-5H3/t11-,12+,13-,15-,16-/m1/s1
InChIKey IKGZTPQHVMYZNE-STGWMILLSA-N
Mol Weight 316.39 g/mol
Molecular Formula C16H28O6
Exact Mass 316.188589 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1qRBe4Fdu6V
Name (2R,3R,4aR,7R,12aS)-2,3-Dimethoxy-2,3,7-trimethyl-decahydro-1,4,6-trioxa-benzocyclodecen-5-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H28O6
InChI InChI=1S/C16H28O6/c1-11-9-7-6-8-10-12-13(14(17)20-11)22-16(3,19-5)15(2,18-4)21-12/h11-13H,6-10H2,1-5H3/t11-,12+,13-,15-,16-/m1/s1
InChIKey IKGZTPQHVMYZNE-STGWMILLSA-N
Molecular Weight 316.394 g/mol
SMILES [C@@]12(O[C@]([C@@](OC)(C)O[C@]2(CCCCC[C@](OC1=O)(C)[H])[H])(OC)C)[H]
SPLASH splash10-014l-9510000000-1342746a7654db9eefa7
Source of Spectrum F5-3-1086-16
Synonyms Octahydro-2,3-dimethoxy-2,3,7-trimethyl-4aH-[1,4]dioxino[2,3-c]oxecin-5(11H)-one (2R,3R,4aR,7R,12aS)-2,3-dimethoxy-2,3,7-trimethyloctahydro-2H-[1,4]dioxino[2,3-c]oxecin-5(3H)-one
Wiley ID 1732217