Debug Info

object
{15}
_id
:
HtLVNEDW5Vo
spectrumID
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HtLVNEDW5Vo
cost
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1
specType
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262144
xnmrNucleus
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dbLocation
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NCX:311:1
hasStructureAssignments
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properties
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analyticalTechnique
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13C NMR
analyticalTechniqueLongName
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13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
isFullSpectrum
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false
spectralOutlier
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compound
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1735074081058
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1,3-Propanediol
SpectraBase Compound ID LCRCvinuba2
InChI InChI=1S/C3H8O2/c4-2-1-3-5/h4-5H,1-3H2
InChIKey YPFDHNVEDLHUCE-UHFFFAOYSA-N
Mol Weight 76.09 g/mol
Molecular Formula C3H8O2
Exact Mass 76.052429 g/mol
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13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HtLVNEDW5Vo
Name 1,3-PROPANEDIOL
Source of Sample Shell Chemical Corporation, New York, New York
Boiling Point 214C
Copyright Copyright © 1980, 1981-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C3H8O2
InChI InChI=1S/C3H8O2/c4-2-1-3-5/h4-5H,1-3H2
InChIKey YPFDHNVEDLHUCE-UHFFFAOYSA-N
Molecular Weight 76.10
Solvent Water; Reference=Dioxane Spectrometer= Varian HA-100/Digilab FT-NMR-3
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