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3-(Pyrimidin-5-ylthio)hexan-1-ol

View entire compound with spectra: 1 MS (GC)

3-(Pyrimidin-5-ylthio)hexan-1-ol
SpectraBase Compound ID 3RO38mdEuzu
InChI InChI=1S/C10H16N2OS/c1-2-3-9(4-5-13)14-10-6-11-8-12-7-10/h6-9,13H,2-5H2,1H3
InChIKey PBDWVAMHYSLZKL-UHFFFAOYSA-N
Mol Weight 212.31 g/mol
Molecular Formula C10H16N2OS
Exact Mass 212.098334 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AxdCHWLuDtz
Name 3-(Pyrimidin-5-ylthio)hexan-1-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H16N2OS
InChI InChI=1S/C10H16N2OS/c1-2-3-9(4-5-13)14-10-6-11-8-12-7-10/h6-9,13H,2-5H2,1H3
InChIKey PBDWVAMHYSLZKL-UHFFFAOYSA-N
Literature Reference DOI 10.1021/acs.orglett.6b00208
Molecular Weight 212.311 g/mol
SMILES OCCC(CCC)Sc1cncnc1
SPLASH splash10-08fr-9540000000-5253aca0c748a976323a
Source of Spectrum A1-18-876/SM21-3q
Wiley ID 1805252