Debug Info

object
{15}
_id
:
AfL9EbFKkwP
spectrumID
:
AfL9EbFKkwP
cost
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1
specType
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131072
xnmrNucleus
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0
dbLocation
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WMSL3X:152084:1
hasStructureAssignments
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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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compound
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lastUpdated
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1735074081058
isDeprecated
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false

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(2S,3R,5S,6S)-5-benzoxy-6-(iodomethyl)-2-methoxy-tetrahydropyran-3-ol
SpectraBase Compound ID AfmyraOujL3
InChI InChI=1S/C14H19IO4/c1-17-14-11(16)7-12(13(8-15)19-14)18-9-10-5-3-2-4-6-10/h2-6,11-14,16H,7-9H2,1H3/t11-,12+,13-,14+/m1/s1
InChIKey YVCNNJFNQSAKDQ-RQJABVFESA-N
Mol Weight 378.21 g/mol
Molecular Formula C14H19IO4
Exact Mass 378.032804 g/mol
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Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AfL9EbFKkwP
Name (2S,3R,5S,6S)-5-benzoxy-6-(iodomethyl)-2-methoxy-tetrahydropyran-3-ol
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H19IO4
InChI InChI=1S/C14H19IO4/c1-17-14-11(16)7-12(13(8-15)19-14)18-9-10-5-3-2-4-6-10/h2-6,11-14,16H,7-9H2,1H3/t11-,12+,13-,14+/m1/s1
InChIKey YVCNNJFNQSAKDQ-RQJABVFESA-N
Molecular Weight 378.206 g/mol
SMILES O[C@]1([C@](O[C@@]([C@](C1)(OCc1ccccc1)[H])(CI)[H])(OC)[H])[H]
SPLASH splash10-016r-0930000000-f240664f6be22865e1fc
Source of Spectrum F-62-6932-0
Synonyms (2S,3R,5S,6S)-5-benzyloxy-6-(iodomethyl)-2-methoxy-tetrahydropyran-3-ol (2S,3R,5S,6S)-6-(iodanylmethyl)-2-methoxy-5-phenylmethoxy-oxan-3-ol (2S,3R,5S,6S)-6-(iodomethyl)-2-methoxy-5-phenylmethoxy-3-oxanol (2S,3R,5S,6S)-6-(iodomethyl)-2-methoxy-5-phenylmethoxyoxan-3-ol
Wiley ID 1639846
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