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Grandisin
SpectraBase Compound ID HgEhPq9DZjF
InChI InChI=1S/C24H32O7/c1-13-14(2)22(16-11-19(27-5)24(30-8)20(12-16)28-6)31-21(13)15-9-17(25-3)23(29-7)18(10-15)26-4/h9-14,21-22H,1-8H3/t13-,14-,21-,22-/m1/s1
InChIKey ZPINJJOPURFFNV-LPINMEDASA-N
Mol Weight 432.5 g/mol
Molecular Formula C24H32O7
Exact Mass 432.214803 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2ffMPFjrsb8
Name Grandisin
CAS Registry Number 50393-99-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H32O7
InChI InChI=1S/C24H32O7/c1-13-14(2)22(16-11-19(27-5)24(30-8)20(12-16)28-6)31-21(13)15-9-17(25-3)23(29-7)18(10-15)26-4/h9-14,21-22H,1-8H3/t13-,14-,21-,22-/m1/s1
InChIKey ZPINJJOPURFFNV-LPINMEDASA-N
Molecular Weight 432.513 g/mol
SMILES [C@@]1(O[C@]([C@@]([C@]1(C)[H])(C)[H])(c1cc(OC)c(c(c1)OC)OC)[H])(c1cc(OC)c(c(c1)OC)OC)[H]
SPLASH splash10-014i-9200000000-518b884279e8b0560ca4
Source of Spectrum X2-54-1682-1
Synonyms (2R,3R,4R,5R)-3,4-dimethyl-2,5-bis(3,4,5-trimethoxyphenyl)oxolane (2R,3R,4R,5R)-3,4-Dimethyl-2,5-bis(3,4,5-trimethoxyphenyl)tetrahydrofuran
Wiley ID 1604288