Debug Info

object
{15}
_id
:
1eNQYcvHwA1
spectrumID
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1eNQYcvHwA1
cost
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1
specType
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131072
xnmrNucleus
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0
dbLocation
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WMSL3X:159815:1
hasStructureAssignments
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false
properties
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analyticalTechnique
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MS (GC)
analyticalTechniqueLongName
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Mass Spectrum (GC)
isFullSpectrum
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false
spectralOutlier
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false
compound
{10}
lastUpdated
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1735074081058
isDeprecated
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false

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Busaliol
SpectraBase Compound ID 7JG5eigsP81
InChI InChI=1S/C21H26O7/c1-25-17-7-12(4-5-16(17)22)6-14-10-28-11-15(14)20(23)13-8-18(26-2)21(24)19(9-13)27-3/h4-5,7-9,14-15,20,22-24H,6,10-11H2,1-3H3
InChIKey XYTZIYNRZGBMDA-UHFFFAOYSA-N
Mol Weight 390.43 g/mol
Molecular Formula C21H26O7
Exact Mass 390.167853 g/mol
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Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1eNQYcvHwA1
Name Busaliol
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H26O7
InChI InChI=1S/C21H26O7/c1-25-17-7-12(4-5-16(17)22)6-14-10-28-11-15(14)20(23)13-8-18(26-2)21(24)19(9-13)27-3/h4-5,7-9,14-15,20,22-24H,6,10-11H2,1-3H3
InChIKey XYTZIYNRZGBMDA-UHFFFAOYSA-N
Molecular Weight 390.432 g/mol
SMILES Oc1c(cc(CC2C(C(c3cc(OC)c(c(c3)OC)O)O)COC2)cc1)OC
SPLASH splash10-001r-0901000000-7af10f387e5eb7433e78
Source of Spectrum G4-58-891-1
Synonyms 3-[3',5'-Dimethoxy-4'-hydroxy-.alpha.-hydroxybenzyl]-4-[3''-methoxy-4''-hydroxybenzyl]-tetrahydrofuran 4-{hydroxy[4-(4-hydroxy-3-methoxybenzyl)tetrahydro-3-furanyl]methyl}-2,6-dimethoxyphenol 4-[hydroxy-[4-[(4-hydroxy-3-methoxyphenyl)methyl]-3-oxolanyl]methyl]-2,6-dimethoxyphenol 4-[hydroxy-[4-[(4-hydroxy-3-methoxyphenyl)methyl]oxolan-3-yl]methyl]-2,6-dimethoxyphenol 4-[hydroxy-[4-[(4-hydroxy-3-methoxy-phenyl)methyl]tetrahydrofuran-3-yl]methyl]-2,6-dimethoxy-phenol 2,6-Dimethoxy-4-[[4-[(3-methoxy-4-oxidanyl-phenyl)methyl]oxolan-3-yl]-oxidanyl-methyl]phenol
Wiley ID 1605948
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