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2-Pyridinol, 1-acetyl-4-tert-butyl-3,6-bis(tert-butylthio)-1,2,3,6-tetrahydro-, acetate (ester)

View entire compound with spectra: 3 MS (GC)

2-Pyridinol, 1-acetyl-4-tert-butyl-3,6-bis(tert-butylthio)-1,2,3,6-tetrahydro-, acetate (ester)
SpectraBase Compound ID 1M4jnMDCLoj
InChI InChI=1S/C21H37NO3S2/c1-13(23)22-16(26-20(6,7)8)12-15(19(3,4)5)17(27-21(9,10)11)18(22)25-14(2)24/h12,16-18H,1-11H3
InChIKey HVGSPMLKOZDGFJ-UHFFFAOYSA-N
Mol Weight 415.7 g/mol
Molecular Formula C21H37NO3S2
Exact Mass 415.221486 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FvpV3pZvurD
Name 2-Acetoxy-1-acetyl-4-tert-butyl-3,6-di-tert-butylmercapto-1,2,3,6-tetrahydropyridine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H37NO3S2
InChI InChI=1S/C21H37NO3S2/c1-13(23)22-16(26-20(6,7)8)12-15(19(3,4)5)17(27-21(9,10)11)18(22)25-14(2)24/h12,16-18H,1-11H3
InChIKey HVGSPMLKOZDGFJ-UHFFFAOYSA-N
Ionization Type EI-B
Molecular Weight 415.651 g/mol
SMILES CC(=O)OC1N(C(C)=O)C(C=C(C1SC(C)(C)C)C(C)(C)C)SC(C)(C)C
SPLASH splash10-06b9-7923000000-87b55bbbaf5a7e7538fe
Source of Spectrum SRH-2022-3029-0
Wiley ID 1825366