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6-Aza-2-thiothymine
SpectraBase Compound ID 68BWA5xNghX
InChI InChI=1S/C4H5N3OS/c1-2-3(8)5-4(9)7-6-2/h1H3,(H2,5,7,8,9)
InChIKey NKOPQOSBROLOFP-UHFFFAOYSA-N
Mol Weight 143.16 g/mol
Molecular Formula C4H5N3OS
Exact Mass 143.015333 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID KinfppC1hIP
Name 6-Aza-2-thiothymine
Source of Sample Sigma-Aldrich Company LLC
Catalog Number 275514
Lot Number 07011EO
CAS Registry Number 615-76-9
Cell Type NMR tube
Compound Type Pure
Copyright Copyright © 2015-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C4H5N3OS
InChI InChI=1S/C4H5N3OS/c1-2-3(8)5-4(9)7-6-2/h1H3,(H2,5,7,8,9)
InChIKey NKOPQOSBROLOFP-UHFFFAOYSA-N
Molecular Weight 143.164 g/mol
Raman Corrections Referenced to internal white light source; 180 degree backscatter
Raman Laser Power 510 mW
Raman Laser Source Nd:YAG
SMILES N1C(\C(=N/NC1=S)C)=O
Scans Performed 4096
Source of Spectrum Forensic Spectral Research
Technique FT-Raman