Debug Info

object
{15}
_id
:
6SzVk2X71T4
spectrumID
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6SzVk2X71T4
cost
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1
specType
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4096
xnmrNucleus
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0
dbLocation
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SAX:29888:17997457154752735186
hasStructureAssignments
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properties
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analyticalTechnique
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FTIR
analyticalTechniqueLongName
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Transmission Infrared (IR) Spectrum
isFullSpectrum
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true
spectralOutlier
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compound
{10}
lastUpdated
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1735074081058
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false

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Hexanoic acid pentyl ester
SpectraBase Compound ID GQcKFT1ZQf3
InChI InChI=1S/C11H22O2/c1-3-5-7-9-11(12)13-10-8-6-4-2/h3-10H2,1-2H3
InChIKey WRFZKAGPPQGDDQ-UHFFFAOYSA-N
Mol Weight 186.29 g/mol
Molecular Formula C11H22O2
Exact Mass 186.16198 g/mol
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Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID 6SzVk2X71T4
Name HEXANOIC ACID, PENTYL ESTER
Source of Sample EASTMAN ORGANIC CHEMICALS, ROCHESTER, NEW YORK
Catalog Number 2949
Boiling Point 103-104C/11mm
CAS Registry Number 540-07-8
Copyright Copyright © 1980, 1981-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H22O2
InChI InChI=1S/C11H22O2/c1-3-5-7-9-11(12)13-10-8-6-4-2/h3-10H2,1-2H3
InChIKey WRFZKAGPPQGDDQ-UHFFFAOYSA-N
Molecular Weight 186.294998
Technique CAPILLARY CELL: NEAT
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