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1,4,5,6-tetra-O-acetyl-(1-deuterio)-2,3-di-O-methyl-D-mannitol
SpectraBase Compound ID DP5FX36OW4H
InChI InChI=1S/C16H26O10/c1-9(17)23-7-13(21-5)15(22-6)16(26-12(4)20)14(25-11(3)19)8-24-10(2)18/h13-16H,7-8H2,1-6H3/t13-,14-,15-,16-/m1/s1/i7D/t7?,13-,14-,15-,16-
InChIKey UUPZYXOWVJCPJT-PECNIIAXSA-N
Mol Weight 379.38 g/mol
Molecular Formula C16H25DO10
Exact Mass 379.158874 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AAovLMTIKxd
Name 1,4,5,6-tetra-O-acetyl-(1-deuterio)-2,3-di-O-methyl-D-mannitol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 379.158873773 u
Formula C16H25DO10
InChI InChI=1S/C16H26O10/c1-9(17)23-7-13(21-5)15(22-6)16(26-12(4)20)14(25-11(3)19)8-24-10(2)18/h13-16H,7-8H2,1-6H3/t13-,14-,15-,16-/m1/s1/i7D/t7?,13-,14-,15-,16-
InChIKey UUPZYXOWVJCPJT-PECNIIAXSA-N
Instrument Name GCMS
Ionization Type EI
Literature Reference DOI 10.1002/cbdv.202300161
Molecular Weight 379.380 g/mol
Quality 304
SMILES C(OC(C)=O)([C@]([C@@](OC)([C@@]([C@](OC(=O)C)(COC(C)=O)[H])(OC(C)=O)[H])[H])(OC)[H])[D]
SPLASH splash10-014m-7900000000-c2775447f8abae2f75db
Source of Spectrum CBD-20-SM18-Table 2, Entry 8 (DOI: 10.1002/cbdv.202300161)
Wiley ID 1911345