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1,4-Anhydrohexitol
SpectraBase Compound ID FiJwslPkjzg
InChI InChI=1S/C6H12O5/c7-1-3(8)6-5(10)4(9)2-11-6/h3-10H,1-2H2/t3-,4-,5-,6-/m1/s1
InChIKey JNYAEWCLZODPBN-KVTDHHQDSA-N
Mol Weight 164.16 g/mol
Molecular Formula C6H12O5
Exact Mass 164.068473 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BPeg0RiBdpU
Name 1,4-Anhydrohexitol
CAS Registry Number 7726-97-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H12O5
InChI InChI=1S/C6H12O5/c7-1-3(8)6-5(10)4(9)2-11-6/h3-10H,1-2H2/t3-,4-,5-,6-/m1/s1
InChIKey JNYAEWCLZODPBN-KVTDHHQDSA-N
Molecular Weight 164.157 g/mol
SMILES O[C@@]([C@]1(OC[C@]([C@]1(O)[H])(O)[H])[H])(CO)[H]
SPLASH splash10-059g-9000000000-5b62ff5b36186afad0f8
Synonyms 1,4-Anhydro-d-galactitol 1,4-Anhydro-d-mannitol 2-(1,2-dihydroxyethyl)oxolane-3,4-diol 2-(1,2-dihydroxyethyl)tetrahydrofuran-3,4-diol 2-[1,2-bis(oxidanyl)ethyl]oxolane-3,4-diol D-Glucitol, 1,4-anhydro- d-Mannitol, 1,4-anhydro-
Wiley ID 1501864