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1-(3-Hydroxyphenyl)-4,4,6-trimethyl-3,4-dihydro-2(1H)-pyrimidinethione
SpectraBase Compound ID 51F37a7JN5y
InChI InChI=1S/C13H16N2OS/c1-9-8-13(2,3)14-12(17)15(9)10-5-4-6-11(16)7-10/h4-8,16H,1-3H3,(H,14,17)
InChIKey OZXSXXNDYSDVEU-UHFFFAOYSA-N
Mol Weight 248.34 g/mol
Molecular Formula C13H16N2OS
Exact Mass 248.098334 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J1AsaMKfAz9
Name 1-(3-Hydroxyphenyl)-4,4,6-trimethyl-3,4-dihydro-2(1H)-pyrimidinethione
Alternate Name(s) 1-(m-Hydroxyphenyl)-2-thio-4,4,6-trimethyl dihydropyrimidine 2(1H)-Pyrimidinethione, 3,4-dihydro-1-(m-hydroxyphenyl)-4,4,6-trimethyl- 3-(3-hydroxyphenyl)-4,6,6-trimethyl-1H-pyrimidine-2-thione Pyrimidine-2(1H)-thione, 3,4-dihydro-1-(3-hydroxyphenyl)-4,4,6-trimethyl- USAF K-1345
CAS Registry Number 63704-47-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16N2OS
InChI InChI=1S/C13H16N2OS/c1-9-8-13(2,3)14-12(17)15(9)10-5-4-6-11(16)7-10/h4-8,16H,1-3H3,(H,14,17)
InChIKey OZXSXXNDYSDVEU-UHFFFAOYSA-N
Molecular Weight 248.344 g/mol
SMILES N1C(C=C(N(c2cccc(c2)O)C1=S)C)(C)C
SPLASH splash10-001i-7490000000-a4433f472ee04964dc70
Source of Spectrum AD-0-2532-0
Wiley ID 1427865