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6-(aminothio)-5-butylpyrimidin-2(1H)-one

View entire compound with spectra: 1 MS (GC)

6-(aminothio)-5-butylpyrimidin-2(1H)-one
SpectraBase Compound ID 9uPMRivPpsq
InChI InChI=1S/C8H13N3OS/c1-2-3-4-6-5-10-8(12)11-7(6)13-9/h5H,2-4,9H2,1H3,(H,10,11,12)
InChIKey KYCBLTCXWJGIFP-UHFFFAOYSA-N
Mol Weight 199.27 g/mol
Molecular Formula C8H13N3OS
Exact Mass 199.077933 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9SvwwxknV4S
Name 6-(aminothio)-5-butylpyrimidin-2(1H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H13N3OS
InChI InChI=1S/C8H13N3OS/c1-2-3-4-6-5-10-8(12)11-7(6)13-9/h5H,2-4,9H2,1H3,(H,10,11,12)
InChIKey KYCBLTCXWJGIFP-UHFFFAOYSA-N
Literature Reference DOI 10.1002/prac.19973390129
Molecular Weight 199.272 g/mol
SMILES N1C(SN)=C(C=NC1=O)CCCC
SPLASH splash10-0ue9-9600000000-e6a3ca385a6ab6e1f7b2
Source of Spectrum JF-399-156-9f
Wiley ID 1768345