Debug Info

object
{15}
_id
:
CWPVWSeTm7p
spectrumID
:
CWPVWSeTm7p
cost
:
1
specType
:
8192
xnmrNucleus
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0
dbLocation
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JPX:8:1
hasStructureAssignments
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false
properties
{11}
analyticalTechnique
:
Near IR
analyticalTechniqueLongName
:
Near Infrared (NIR) Spectrum
isFullSpectrum
:
true
spectralOutlier
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false
compound
{10}
lastUpdated
:
1735074081058
isDeprecated
:
false

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A-Toluenethiol
SpectraBase Compound ID 5ZgH7p1M5K3
InChI InChI=1S/C7H8S/c8-6-7-4-2-1-3-5-7/h1-5,8H,6H2
InChIKey UENWRTRMUIOCKN-UHFFFAOYSA-N
Mol Weight 124.2 g/mol
Molecular Formula C7H8S
Exact Mass 124.034671 g/mol
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Near Infrared (NIR) Spectrum

Near Infrared (NIR) Spectrum

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SpectraBase Spectrum ID CWPVWSeTm7p
Name Benzenemethanethiol
Comments Window Material: QI
Copyright Copyright © 1989, 1990-2025 Wiley-VCH GmbH. All Rights Reserved.
Formula C7H8S
InChI InChI=1S/C7H8S/c8-6-7-4-2-1-3-5-7/h1-5,8H,6H2
InChIKey UENWRTRMUIOCKN-UHFFFAOYSA-N
Instrument Name INSTRUMENT PARAMETERS=INST=BRUKER,RSN=2207,REO=2,CNM=HEI,ZFF=2
Purity 99%
Sample Description STATE=NEAT, LIQUID
Source of Spectrum Prof. Buback, University of Goettingen, Germany
Technique NIR Spectrometer= BRUKER IFS 88
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