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1-S-[(1E)-N-Hydroxy-3-buteinimidoyl]-1-thiohexopyranose

View entire compound with spectra: 1 MS (GC)

1-S-[(1E)-N-Hydroxy-3-buteinimidoyl]-1-thiohexopyranose
SpectraBase Compound ID CXf0zhIqQzj
InChI InChI=1S/C10H17NO6S/c1-2-3-6(11-16)18-10-9(15)8(14)7(13)5(4-12)17-10/h2,5,7-10,12-16H,1,3-4H2/b11-6+/t5-,7-,8+,9-,10-/m1/s1
InChIKey NMXWTQFCMCVSFH-ZJOGEHIDSA-N
Mol Weight 279.31 g/mol
Molecular Formula C10H17NO6S
Exact Mass 279.077658 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID It7z8X743Rl
Name 1-S-[(1E)-N-Hydroxy-3-buteinimidoyl]-1-thiohexopyranose
Carrier Gas Helium
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 279.077658439 u
Formula C10H17NO6S
GC Column Elite-1 (30 mm x 0.25 mm, film thickness 0.25 micrometer)
GC Oven Program Oven temp 310oC
InChI InChI=1S/C10H17NO6S/c1-2-3-6(11-16)18-10-9(15)8(14)7(13)5(4-12)17-10/h2,5,7-10,12-16H,1,3-4H2/b11-6+/t5-,7-,8+,9-,10-/m1/s1
InChIKey NMXWTQFCMCVSFH-ZJOGEHIDSA-N
Instrument Name Agilent model GC 7890A-5973A MS
Ionization Type EI
Literature Reference DOI 10.1016/j.arabjc.2022.104055
Quality 1000
SMILES O[C@@]1([C@](O[C@](S\C(=N\O)CC=C)([C@@]([C@]1(O)[H])(O)[H])[H])(CO)[H])[H]
SPLASH splash10-01ox-9100000000-43e363bbc7e525552efc
Sample Comments Desulphosinigrin
Source of Spectrum AJC-15-12-DES (DOI: 10.1016/j.arabjc.2022.104055)
Wiley ID 1909721