Debug Info

object
{15}
_id
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CoXciU2qML0
spectrumID
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CoXciU2qML0
cost
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1
specType
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131072
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dbLocation
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WMSL3X:212284:1
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properties
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analyticalTechnique
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MS (GC)
analyticalTechniqueLongName
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Mass Spectrum (GC)
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compound
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1735074081058
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2-[(Benzyloxy)methyl]-3,4-bis(benzyloxy)-5-formyl-6-hexyl-perhydro-pyran
SpectraBase Compound ID Ah3rxqveznW
InChI InChI=1S/C34H42O5/c1-2-3-4-14-21-31-30(22-35)33(37-24-28-17-10-6-11-18-28)34(38-25-29-19-12-7-13-20-29)32(39-31)26-36-23-27-15-8-5-9-16-27/h5-13,15-20,22,30-34H,2-4,14,21,23-26H2,1H3/t30-,31+,32-,33-,34-/m1/s1
InChIKey SYVVFOVRAKDTPL-KKYNAJBLSA-N
Mol Weight 530.7 g/mol
Molecular Formula C34H42O5
Exact Mass 530.303224 g/mol
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Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CoXciU2qML0
Name 2-[(Benzyloxy)methyl]-3,4-bis(benzyloxy)-5-formyl-6-hexyl-perhydro-pyran
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C34H42O5
InChI InChI=1S/C34H42O5/c1-2-3-4-14-21-31-30(22-35)33(37-24-28-17-10-6-11-18-28)34(38-25-29-19-12-7-13-20-29)32(39-31)26-36-23-27-15-8-5-9-16-27/h5-13,15-20,22,30-34H,2-4,14,21,23-26H2,1H3/t30-,31+,32-,33-,34-/m1/s1
InChIKey SYVVFOVRAKDTPL-KKYNAJBLSA-N
Molecular Weight 530.705 g/mol
SMILES [C@]1([C@]([C@](OCc2ccccc2)([C@](O[C@]1(CCCCCC)[H])(COCc1ccccc1)[H])[H])(OCc1ccccc1)[H])(C=O)[H]
SPLASH splash10-0006-9110000000-0cb9871a7a91fe9c154b
Source of Spectrum D1-2000-736-3
Synonyms (2R,3R,4S,5R,6S)-2-[(Benzyloxy)methyl]-3,4-bis(benzyloxy)-5-formyl-6-hexyl-perhydro-pyran 1,5-anhydro-3,4,6-tri-O-benzyl-2-deoxy-2-formyl-1-hexylhexitol
Wiley ID 835443
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