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5H-Pyrano[2,3-d]oxazole-6,7-diol, 3a,6,7,7a-tetrahydro-2-(methylthio)-, [3aR-(3a.alpha.,6.alpha.,7.alpha.,7a.alpha.)]-
SpectraBase Compound ID It68uyIsCkC
InChI InChI=1S/C7H11NO4S/c1-13-7-8-6-5(12-7)4(10)3(9)2-11-6/h3-6,9-10H,2H2,1H3/t3-,4-,5+,6-/m1/s1
InChIKey FWOOGOKANGJBIQ-ARQDHWQXSA-N
Mol Weight 205.23 g/mol
Molecular Formula C7H11NO4S
Exact Mass 205.040879 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B9GhmN3VOLk
Name 5H-Pyrano[2,3-d]oxazole-6,7-diol, 3a,6,7,7a-tetrahydro-2-(methylthio)-, [3aR-(3a.alpha.,6.alpha.,7.alpha.,7a.alpha.)]-
CAS Registry Number 101029-59-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H11NO4S
InChI InChI=1S/C7H11NO4S/c1-13-7-8-6-5(12-7)4(10)3(9)2-11-6/h3-6,9-10H,2H2,1H3/t3-,4-,5+,6-/m1/s1
InChIKey FWOOGOKANGJBIQ-ARQDHWQXSA-N
Molecular Weight 205.228 g/mol
SMILES O[C@]1([C@]2([C@@](OC[C@]1(O)[H])(N=C(O2)SC)[H])[H])[H]
SPLASH splash10-014i-9600000000-df26481d8bddc9cc1796
Source of Spectrum O-20-460-5
Synonyms (3aR,6R,7R,7aS)-2-(methylsulfanyl)-5,6,7,7a-tetrahydro-3aH-pyrano[2,3-d][1,3]oxazole-6,7-diol 2-Methylthio-(1,2-dideoxy-.beta.-D-arabinopyrano)(1,2-d)-2-oxazoline
Wiley ID 1203166