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3-(Acetyloxy)-4-[3-(4-methoxyphenyl)-4,6,6-trimethyl-2-thioxohexahydro-4-pyrimidinyl]phenyl acetate

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

3-(Acetyloxy)-4-[3-(4-methoxyphenyl)-4,6,6-trimethyl-2-thioxohexahydro-4-pyrimidinyl]phenyl acetate
SpectraBase Compound ID 2UBsvcZ8hRX
InChI InChI=1S/C24H28N2O5S/c1-15(27)30-19-11-12-20(21(13-19)31-16(2)28)24(5)14-23(3,4)25-22(32)26(24)17-7-9-18(29-6)10-8-17/h7-13H,14H2,1-6H3,(H,25,32)
InChIKey XJSYCTQSZZZRNE-UHFFFAOYSA-N
Mol Weight 456.56 g/mol
Molecular Formula C24H28N2O5S
Exact Mass 456.171893 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BZgSYENFw0X
Name 3-(acetyloxy)-4-[3-(4-methoxyphenyl)-4,6,6-trimethyl-2-thioxohexahydro-4-pyrimidinyl]phenyl acetate
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H28N2O5S
InChI InChI=1S/C24H28N2O5S/c1-15(27)30-19-11-12-20(21(13-19)31-16(2)28)24(5)14-23(3,4)25-22(32)26(24)17-7-9-18(29-6)10-8-17/h7-13H,14H2,1-6H3,(H,25,32)
InChIKey XJSYCTQSZZZRNE-UHFFFAOYSA-N
Molecular Weight 456.557 g/mol
SMILES N1C(CC(N(C1=S)c1ccc(cc1)OC)(c1c(cc(cc1)OC(=O)C)OC(=O)C)C)(C)C
SPLASH splash10-052f-4623900000-14444be0965446b4d1f3
Synonyms Acetic acid 5-acetoxy-2-[3-(4-methoxy-phenyl)-4,6,6-trimethyl-2-thioxo-hexahydro-pyrimidin-4-yl]-phenyl ester Acetic acid[3-acetoxy-4-[3-(4-methoxyphenyl)-4,6,6-trimethyl-2-thioxo-hexahydropyrimidin-4-yl]phenyl]ester Acetic acid[3-acetyloxy-4-[3-(4-methoxyphenyl)-4,6,6-trimethyl-2-sulfanylidene-1,3-diazinan-4-yl]phenyl]ester [3-acetoxy-4-[3-(4-methoxyphenyl)-4,6,6-trimethyl-2-thioxo-hexahydropyrimidin-4-yl]phenyl]acetate [3-acetyloxy-4-[3-(4-methoxyphenyl)-4,6,6-trimethyl-2-sulfanylidene-1,3-diazinan-4-yl]phenyl]acetate [3-acetyloxy-4-[3-(4-methoxyphenyl)-4,6,6-trimethyl-2-sulfanylidene-1,3-diazinan-4-yl]phenyl]ethanoate Acetic acid [3-acetyloxy-4-[3-(4-methoxyphenyl)-4,6,6-trimethyl-2-sulfanylidene-1,3-diazinan-4-yl]phenyl] ester [3-acetyloxy-4-[3-(4-methoxyphenyl)-4,6,6-trimethyl-2-sulfanylidene-1,3-diazinan-4-yl]phenyl] acetate [3-acetoxy-4-[3-(4-methoxyphenyl)-4,6,6-trimethyl-2-thioxo-hexahydropyrimidin-4-yl]phenyl] acetate [3-acetyloxy-4-[3-(4-methoxyphenyl)-4,6,6-trimethyl-2-sulfanylidene-1,3-diazinan-4-yl]phenyl] ethanoate
Wiley ID 1443847