Debug Info

object
{15}
_id
:
FZ1A4Cgrar2
spectrumID
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FZ1A4Cgrar2
cost
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1
specType
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131072
xnmrNucleus
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dbLocation
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WMSL3X:88335:1
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properties
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analyticalTechnique
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MS (GC)
analyticalTechniqueLongName
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Mass Spectrum (GC)
isFullSpectrum
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spectralOutlier
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compound
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lastUpdated
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1735074081058
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N-(4-Acetyl-5-(4-chlorophenyl)-4,5-dihydro-1,3,4-thiadiazol-2-yl)-acetamide
SpectraBase Compound ID KEV9iqVc9Zx
InChI InChI=1S/C12H12ClN3O2S/c1-7(17)14-12-15-16(8(2)18)11(19-12)9-3-5-10(13)6-4-9/h3-6,11H,1-2H3,(H,14,15,17)
InChIKey DYTSPVAOPMELKW-UHFFFAOYSA-N
Mol Weight 297.76 g/mol
Molecular Formula C12H12ClN3O2S
Exact Mass 297.033876 g/mol
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Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FZ1A4Cgrar2
Name N-(4-Acetyl-5-(4-chlorophenyl)-4,5-dihydro-1,3,4-thiadiazol-2-yl)-acetamide
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H12ClN3O2S
InChI InChI=1S/C12H12ClN3O2S/c1-7(17)14-12-15-16(8(2)18)11(19-12)9-3-5-10(13)6-4-9/h3-6,11H,1-2H3,(H,14,15,17)
InChIKey DYTSPVAOPMELKW-UHFFFAOYSA-N
Molecular Weight 297.760 g/mol
SMILES N(C(C)=O)C1=NN(C(S1)c1ccc(cc1)Cl)C(=O)C
SPLASH splash10-0f6t-0090000000-4b7da2d924970cb5fa61
Source of Spectrum E1-59-1416-2f
Synonyms N-(4-acetyl-5-(4-chlorophenyl)-4,5-dihydro-1,3,4-thiadiazol-2-yl)acetamide N-[2-(4-chlorophenyl)-3-ethanoyl-2H-1,3,4-thiadiazol-5-yl]ethanamide
Wiley ID 1743718
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