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3,3'-Dimethyl-6,6'-pentylenedioxy-2,2'-biphenyldiol
SpectraBase Compound ID 6eNwRzlSmmR
InChI InChI=1S/C19H22O4/c1-12-6-8-14-16(18(12)20)17-15(9-7-13(2)19(17)21)23-11-5-3-4-10-22-14/h6-9,20-21H,3-5,10-11H2,1-2H3
InChIKey QAYZZTKECAVXFH-UHFFFAOYSA-N
Mol Weight 314.38 g/mol
Molecular Formula C19H22O4
Exact Mass 314.151809 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ISQLqAPmrSr
Name 3,3'-Dimethyl-6,6'-pentylenedioxy-2,2'-biphenyldiol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H22O4
InChI InChI=1S/C19H22O4/c1-12-6-8-14-16(18(12)20)17-15(9-7-13(2)19(17)21)23-11-5-3-4-10-22-14/h6-9,20-21H,3-5,10-11H2,1-2H3
InChIKey QAYZZTKECAVXFH-UHFFFAOYSA-N
Molecular Weight 314.381 g/mol
SMILES Oc1c2-c3c(c(ccc3OCCCCCOc2ccc1C)C)O
SPLASH splash10-03dj-0159000000-8d654cafb99ba59e37f3
Source of Spectrum F-53-16673-16
Synonyms (S)-3,3'-Dimethyl-6,6'-pentylenedioxy-2,2'-biphenyldiol 2,14-dimethyl-7,8,9,10-tetrahydro-6H-dibenzo[b,d][1,6]dioxacycloundecin-1,15-diol
Wiley ID 804584