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D-arabino-Hexitol, 2,6-anhydro-1-deoxy-4,5-O-(1-methylethylidene)-, dimethylcarbamothioate
SpectraBase Compound ID 8j7RCwExdE0
InChI InChI=1S/C12H21NO4S/c1-7-9(15-11(18)13(4)5)10-8(6-14-7)16-12(2,3)17-10/h7-10H,6H2,1-5H3/t7?,8-,9-,10-/m1/s1
InChIKey WRPYQWUJEWZKKN-NPTNVHDASA-N
Mol Weight 275.36 g/mol
Molecular Formula C12H21NO4S
Exact Mass 275.119129 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BagTiCjyDC2
Name D-arabino-Hexitol, 2,6-anhydro-1-deoxy-4,5-O-(1-methylethylidene)-, dimethylcarbamothioate
CAS Registry Number 69688-58-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H21NO4S
InChI InChI=1S/C12H21NO4S/c1-7-9(15-11(18)13(4)5)10-8(6-14-7)16-12(2,3)17-10/h7-10H,6H2,1-5H3/t7?,8-,9-,10-/m1/s1
InChIKey WRPYQWUJEWZKKN-NPTNVHDASA-N
Molecular Weight 275.363 g/mol
SMILES [C@]12([C@](OC(=S)N(C)C)(C(C)OC[C@]2(OC(O1)(C)C)[H])[H])[H]
SPLASH splash10-05bu-9300000000-c37aab713627cb7f54c5
Source of Spectrum EP-5734-0-0
Synonyms 1-Deoxy-2-O-N,N-dimethylaminothiocarbonyl-3,4-O-isopropylidene-1-methyl arabinopyranose 2,6-anhydro-1-deoxy-3-O-[(dimethylamino)carbothioyl]-4,5-O-(1-methylethylidene)-D-arabino-hexitol
Wiley ID 1278895