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4,4,6-Trimethyl-1-(3-pyridinylmethyl)-3,4-dihydro-2(1H)-pyrimidinethione
SpectraBase Compound ID 2JmfjlIOsTH
InChI InChI=1S/C13H17N3S/c1-10-7-13(2,3)15-12(17)16(10)9-11-5-4-6-14-8-11/h4-8H,9H2,1-3H3,(H,15,17)
InChIKey IOYWKNUAEYFWCY-UHFFFAOYSA-N
Mol Weight 247.36 g/mol
Molecular Formula C13H17N3S
Exact Mass 247.114319 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FUthB6tfEaa
Name 4,4,6-Trimethyl-1-(3-pyridinylmethyl)-3,4-dihydro-2(1H)-pyrimidinethione
CAS Registry Number 313399-47-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H17N3S
InChI InChI=1S/C13H17N3S/c1-10-7-13(2,3)15-12(17)16(10)9-11-5-4-6-14-8-11/h4-8H,9H2,1-3H3,(H,15,17)
InChIKey IOYWKNUAEYFWCY-UHFFFAOYSA-N
Molecular Weight 247.360 g/mol
SMILES N1C(C=C(N(C1=S)Cc1cnccc1)C)(C)C
SPLASH splash10-0006-9320000000-18b697d49cd69e7b49f8
Source of Spectrum AD-0-2532-0
Synonyms 4,6,6-trimethyl-3-(3-pyridinylmethyl)-1H-pyrimidine-2-thione 4,6,6-trimethyl-3-(3-pyridylmethyl)-1H-pyrimidine-2-thione 4,6,6-trimethyl-3-(pyridin-3-ylmethyl)-1H-pyrimidine-2-thione Pyrimidine-2(1H)-thione, 3,4-dihydro4,4,6-trimethyl-1-(3-pyridylmethyl)-
Wiley ID 1426009