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(S)-(+)-5-sec-Butyl-2-pyrimidinthiol

View entire compound with spectra: 2 NMR, and 1 MS (GC)

(S)-(+)-5-sec-Butyl-2-pyrimidinthiol
SpectraBase Compound ID 80ywA1qdoZ7
InChI InChI=1S/C8H12N2S/c1-3-6(2)7-4-9-8(11)10-5-7/h4-6H,3H2,1-2H3,(H,9,10,11)/t6-/m0/s1
InChIKey NVOPNONBMCIZIW-LURJTMIESA-N
Mol Weight 168.26 g/mol
Molecular Formula C8H12N2S
Exact Mass 168.07212 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DMD4TEkHxIn
Name (S)-(+)-5-sec-Butyl-2-pyrimidinthiol
Alternate Name(s) 5-[(1S)-1-methylpropyl]-2-pyrimidinethiol 5-[(1S)-1-methylpropyl]-2-pyrimidinyl hydrosulfide
CAS Registry Number 127473-65-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H12N2S
InChI InChI=1S/C8H12N2S/c1-3-6(2)7-4-9-8(11)10-5-7/h4-6H,3H2,1-2H3,(H,9,10,11)/t6-/m0/s1
InChIKey NVOPNONBMCIZIW-LURJTMIESA-N
Molecular Weight 168.258 g/mol
SMILES Sc1ncc(cn1)[C@](CC)(C)[H]
SPLASH splash10-0aor-0900000000-56d39367648ec0df78f2
Source of Spectrum K-123-2029-15
Wiley ID 1164186