Debug Info

object
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_id
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FudABXPcvXa
spectrumID
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FudABXPcvXa
cost
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Mass Spectrum (GC)
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N-[3-(1-methyl-5-oxidanylidene-2-sulfanylidene-imidazolidin-4-yl)propyl]-1H-pyrrole-2-carboxamide
SpectraBase Compound ID EPetkcOjYHL
InChI InChI=1S/C12H16N4O2S/c1-16-11(18)9(15-12(16)19)5-3-7-14-10(17)8-4-2-6-13-8/h2,4,6,9,13H,3,5,7H2,1H3,(H,14,17)(H,15,19)
InChIKey BOFSJOLTBNKDEZ-UHFFFAOYSA-N
Mol Weight 280.35 g/mol
Molecular Formula C12H16N4O2S
Exact Mass 280.099397 g/mol
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Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FudABXPcvXa
Name N-[3-(1-methyl-5-oxidanylidene-2-sulfanylidene-imidazolidin-4-yl)propyl]-1H-pyrrole-2-carboxamide
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16N4O2S
InChI InChI=1S/C12H16N4O2S/c1-16-11(18)9(15-12(16)19)5-3-7-14-10(17)8-4-2-6-13-8/h2,4,6,9,13H,3,5,7H2,1H3,(H,14,17)(H,15,19)
InChIKey BOFSJOLTBNKDEZ-UHFFFAOYSA-N
Molecular Weight 280.346 g/mol
SMILES N1C(CCCNC(c2[nH]ccc2)=O)C(N(C1=S)C)=O
SPLASH splash10-0006-9070000000-2211bb47a2fb68e850fe
Source of Spectrum Y1-45-1657-5
Synonyms N-[3-(1-methyl-5-oxo-2-sulfanylidene-4-imidazolidinyl)propyl]-1H-pyrrole-2-carboxamide N-[3-(1-methyl-5-oxo-2-sulfanylideneimidazolidin-4-yl)propyl]-1H-pyrrole-2-carboxamide N-[3-(1-methyl-5-oxo-2-thioxo-imidazolidin-4-yl)propyl]-1H-pyrrole-2-carboxamide N-[3-(5-keto-1-methyl-2-thioxo-imidazolidin-4-yl)propyl]-1H-pyrrole-2-carboxamide
Wiley ID 1621871
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