Debug Info

object
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_id
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JvRf0XZXLOw
spectrumID
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JvRf0XZXLOw
cost
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specType
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dbLocation
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hasStructureAssignments
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properties
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analyticalTechnique
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ATR-IR
analyticalTechniqueLongName
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Attenuated Total Reflectance Infrared (ATR-IR) Spectrum
isFullSpectrum
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spectralOutlier
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compound
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(7aS)-(+)-5,6,7,7a-Tetrahydro-7a-methyl-1,5-indandione
SpectraBase Compound ID 7ICeJ16OUY1
InChI InChI=1S/C10H12O2/c1-10-5-4-8(11)6-7(10)2-3-9(10)12/h6H,2-5H2,1H3/t10-/m0/s1
InChIKey FNYAZSZTENLTRT-JTQLQIEISA-N
Mol Weight 164.2 g/mol
Molecular Formula C10H12O2
Exact Mass 164.08373 g/mol
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Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

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SpectraBase Spectrum ID JvRf0XZXLOw
Name (S)-(+)-2,3,7,7a-Tetrahydro-7a-methyl-1H-indene-1,5(6H)-dione
Source of Sample Aldrich
Catalog Number 664073
CAS Registry Number 17553-86-5
Copyright Copyright © 2018-2025 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2018-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H12O2
InChI InChI=1S/C10H12O2/c1-10-5-4-8(11)6-7(10)2-3-9(10)12/h6H,2-5H2,1H3/t10-/m0/s1
InChIKey FNYAZSZTENLTRT-JTQLQIEISA-N
Purity 97%
Synonyms (+)-5,6,7,8-Tetrahydro-8-methylindan-1,5-dione (+)-7,7a-Dihydro-7alpha, beta-methyl-1,5(6H)-indandione (S)-(+)-Hajos-Parrish diketone (S)-Hajos dione (S)-Hajos ketone (S)-Hajos-Wiechert ketone
Wiley ID SIAL_ATR-IR_038981
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