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Benzaldehyde, 3-[3,4-dihydro-7-(methoxymethoxy)-2H-1-benzopyran-3-yl]-2-hydroxy-6-methoxy-, (S)-
SpectraBase Compound ID C3CQmTJLzi1
InChI InChI=1S/C19H20O6/c1-22-11-25-14-4-3-12-7-13(10-24-18(12)8-14)15-5-6-17(23-2)16(9-20)19(15)21/h3-6,8-9,13,21H,7,10-11H2,1-2H3/t13-/m1/s1
InChIKey IDYUXYYRYAMWBZ-CYBMUJFWSA-N
Mol Weight 344.36 g/mol
Molecular Formula C19H20O6
Exact Mass 344.125988 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KqefxPQVdkq
Name Benzaldehyde, 3-[3,4-dihydro-7-(methoxymethoxy)-2H-1-benzopyran-3-yl]-2-hydroxy-6-methoxy-, (S)-
CAS Registry Number 116718-24-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H20O6
InChI InChI=1S/C19H20O6/c1-22-11-25-14-4-3-12-7-13(10-24-18(12)8-14)15-5-6-17(23-2)16(9-20)19(15)21/h3-6,8-9,13,21H,7,10-11H2,1-2H3/t13-/m1/s1
InChIKey IDYUXYYRYAMWBZ-CYBMUJFWSA-N
Molecular Weight 344.363 g/mol
SMILES Oc1c(c(ccc1[C@@]1(Cc2ccc(cc2OC1)OCOC)[H])OC)C=O
SPLASH splash10-00or-0901000000-11395ff727eddaa4d7eb
Source of Spectrum KC-1988-1232-15
Synonyms (3S)-3'-formyl-7-O-methoxymethylvestitol 2-Hydroxy-6-methoxy-3-[(3S)-7-(methoxymethoxy)-3,4-dihydro-2H-chromen-3-yl]benzaldehyde
Wiley ID 1337902