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5-(Acetylsulfanyl)-3-[(2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl)methoxy]pentyl pivalate
SpectraBase Compound ID LxH9za2aTNV
InChI InChI=1S/C17H26N2O6S/c1-12(20)26-10-7-13(6-9-24-15(22)17(2,3)4)25-11-19-8-5-14(21)18-16(19)23/h5,8,13H,6-7,9-11H2,1-4H3,(H,18,21,23)
InChIKey YDVGLUZZIKEVCX-UHFFFAOYSA-N
Mol Weight 386.46 g/mol
Molecular Formula C17H26N2O6S
Exact Mass 386.151158 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 13J4sSdrE9R
Name 5-(Acetylsulfanyl)-3-[(2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl)methoxy]pentyl pivalate
CAS Registry Number 128435-65-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H26N2O6S
InChI InChI=1S/C17H26N2O6S/c1-12(20)26-10-7-13(6-9-24-15(22)17(2,3)4)25-11-19-8-5-14(21)18-16(19)23/h5,8,13H,6-7,9-11H2,1-4H3,(H,18,21,23)
InChIKey YDVGLUZZIKEVCX-UHFFFAOYSA-N
Molecular Weight 386.463 g/mol
SMILES N1C(C=CN(C1=O)COC(CCSC(=O)C)CCOC(=O)C(C)(C)C)=O
SPLASH splash10-055f-9300000000-73897ff85def47b4ebb4
Synonyms Propanoic acid, 2,2-dimethyl-, 5-(acetylthio)-3-[(3,4-dihydro-2,4-dioxo-1(2H)-pyrimidinyl)methoxy]pentyl ester, (R)- 2,2-Dimethylpropanoic acid [5-(acetylthio)-3-[(2,4-dioxo-1-pyrimidinyl)methoxy]pentyl] ester [5-acetylsulfanyl-3-[(2,4-dioxopyrimidin-1-yl)methoxy]pentyl] 2,2-dimethylpropanoate [3-[[2,4-bis(oxidanylidene)pyrimidin-1-yl]methoxy]-5-ethanoylsulfanyl-pentyl] 2,2-dimethylpropanoate
Wiley ID 1487681