Debug Info

object
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_id
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9kvOEDBrWXu
spectrumID
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9kvOEDBrWXu
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specType
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131072
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dbLocation
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WMSL3X:99757:1
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analyticalTechnique
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MS (GC)
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Mass Spectrum (GC)
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compound
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5-Isopropyl-6-(1-naphthylmethyl)-2-thiouracil
SpectraBase Compound ID 1IVR4QmR7zV
InChI InChI=1S/C18H18N2OS/c1-11(2)16-15(19-18(22)20-17(16)21)10-13-8-5-7-12-6-3-4-9-14(12)13/h3-9,11H,10H2,1-2H3,(H2,19,20,21,22)
InChIKey RJQPTLMMYLVISP-UHFFFAOYSA-N
Mol Weight 310.42 g/mol
Molecular Formula C18H18N2OS
Exact Mass 310.113984 g/mol
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Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9kvOEDBrWXu
Name 5-isopropyl-6-(1-naphthylmethyl)-2-thioxo-1H-pyrimidin-4-one
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H18N2OS
InChI InChI=1S/C18H18N2OS/c1-11(2)16-15(19-18(22)20-17(16)21)10-13-8-5-7-12-6-3-4-9-14(12)13/h3-9,11H,10H2,1-2H3,(H2,19,20,21,22)
InChIKey RJQPTLMMYLVISP-UHFFFAOYSA-N
Molecular Weight 310.415 g/mol
SMILES N1C(=C(C(NC1=S)=O)C(C)C)Cc1c2c(cccc2)ccc1
SPLASH splash10-03dj-0379000000-c2cade9906d983bace18
Source of Spectrum E2-51-784-6
Synonyms 6-(1-naphthalenylmethyl)-5-propan-2-yl-2-sulfanylidene-1H-pyrimidin-4-one 6-(naphthalen-1-ylmethyl)-5-propan-2-yl-2-sulfanylidene-1H-pyrimidin-4-one
Wiley ID 1556164
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