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Methyl (2R,4S,8S,8aR,9R)-3,4,6,7,8,8a-Hexahydro-2-methoxy-9-[(4'-methoxyphenyl)methoxy]-2,8-methano-2H-1-benzpyran-4-carboxylate

View entire compound with spectra: 1 MS (GC)

Methyl (2R,4S,8S,8aR,9R)-3,4,6,7,8,8a-Hexahydro-2-methoxy-9-[(4'-methoxyphenyl)methoxy]-2,8-methano-2H-1-benzpyran-4-carboxylate
SpectraBase Compound ID 6C05R8bWPsy
InChI InChI=1S/C21H26O6/c1-23-14-9-7-13(8-10-14)12-26-19-16-6-4-5-15-17(20(22)24-2)11-21(19,25-3)27-18(15)16/h5,7-10,16-19H,4,6,11-12H2,1-3H3/t16-,17-,18?,19+,21-/m0/s1
InChIKey QLDPROSBXNYNIT-YJVUWUJQSA-N
Mol Weight 374.43 g/mol
Molecular Formula C21H26O6
Exact Mass 374.172939 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 93ChAHhPNrz
Name Methyl (2R,4S,8S,8aR,9R)-3,4,6,7,8,8a-Hexahydro-2-methoxy-9-[(4'-methoxyphenyl)methoxy]-2,8-methano-2H-1-benzpyran-4-carboxylate
Alternate Name(s) Methyl (1S,3S,8S,11R)-1-methoxy-11-[(4-methoxybenzyl)oxy]-10-oxatricyclo[6.2.1.0(4,9)]undec-4-ene-3-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H26O6
InChI InChI=1S/C21H26O6/c1-23-14-9-7-13(8-10-14)12-26-19-16-6-4-5-15-17(20(22)24-2)11-21(19,25-3)27-18(15)16/h5,7-10,16-19H,4,6,11-12H2,1-3H3/t16-,17-,18?,19+,21-/m0/s1
InChIKey QLDPROSBXNYNIT-YJVUWUJQSA-N
Molecular Weight 374.433 g/mol
SMILES [C@@]12(OC3[C@@]([C@]2(OCc2ccc(cc2)OC)[H])(CCC=C3[C@](C1)(C(=O)OC)[H])[H])OC
SPLASH splash10-0006-0930000000-c518b32e2f7c2f11b081
Source of Spectrum K-2001-2202-4
Wiley ID 1579610