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1-(N-Isopropylideneamino)-1,6-dihydro-2-methylthio-6-oxopyrimidine

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1-(N-Isopropylideneamino)-1,6-dihydro-2-methylthio-6-oxopyrimidine
SpectraBase Compound ID AYLrEzCvKzH
InChI InChI=1S/C8H11N3OS/c1-6(2)10-11-7(12)4-5-9-8(11)13-3/h4-5H,1-3H3
InChIKey DYVALVDNVUVJRL-UHFFFAOYSA-N
Mol Weight 197.26 g/mol
Molecular Formula C8H11N3OS
Exact Mass 197.062283 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID LgLfoiKrSO
Name 1-(N-Isopropylideneamino)-1,6-dihydro-2-methylthio-6-oxopyrimidine
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 197.062283159 u
Formula C8H11N3OS
InChI InChI=1S/C8H11N3OS/c1-6(2)10-11-7(12)4-5-9-8(11)13-3/h4-5H,1-3H3
InChIKey DYVALVDNVUVJRL-UHFFFAOYSA-N
Molecular Weight 197.256 g/mol
SMILES C1(=NC=CC(N1N=C(C)C)=O)SC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.936566