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(6aS,10S,10aR)-methyl 7,7-diethoxy-3-hydroxy-6a,7,8,9,10,10a-hexahydro-6H-benzo[c]chromene-10-carboxylate
SpectraBase Compound ID 9T5LMKbqbsR
InChI InChI=1S/C19H26O6/c1-4-24-19(25-5-2)9-8-14(18(21)22-3)17-13-7-6-12(20)10-16(13)23-11-15(17)19/h6-7,10,14-15,17,20H,4-5,8-9,11H2,1-3H3/t14-,15+,17-/m0/s1
InChIKey OBPBCZLAUZTEKQ-UXLLHSPISA-N
Mol Weight 350.41 g/mol
Molecular Formula C19H26O6
Exact Mass 350.172939 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ffcybab6R0c
Name (6aS,10S,10aR)-methyl 7,7-diethoxy-3-hydroxy-6a,7,8,9,10,10a-hexahydro-6H-benzo[c]chromene-10-carboxylate
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H26O6
InChI InChI=1S/C19H26O6/c1-4-24-19(25-5-2)9-8-14(18(21)22-3)17-13-7-6-12(20)10-16(13)23-11-15(17)19/h6-7,10,14-15,17,20H,4-5,8-9,11H2,1-3H3/t14-,15+,17-/m0/s1
InChIKey OBPBCZLAUZTEKQ-UXLLHSPISA-N
Literature Reference DOI 10.1021/co200107s
Molecular Weight 350.411 g/mol
SMILES Oc1ccc2c(OC[C@]3(C(CC[C@@]([C@]23[H])(C(=O)OC)[H])(OCC)OCC)[H])c1
SPLASH splash10-052f-9200000000-d20c6328660e2cb1d639
Source of Spectrum ACS-13-554/SM36-25{5,2}
Wiley ID 1754095