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Diisopropyl 2-(4,5-Dihydroxy-6-methoxy-2-methylsulfanyl-3-phentylsulfanyltetrahydrothiapyranyl)phosphonate
SpectraBase Compound ID 4EKjuBXILxh
InChI InChI=1S/C19H31O6PS3/c1-12(2)24-26(22,25-13(3)4)19(27-6)17(28-14-10-8-7-9-11-14)15(20)16(21)18(23-5)29-19/h7-13,15-18,20-21H,1-6H3/t15-,16+,17+,18+,19-/m0/s1
InChIKey NGPXHJPPXVIBIF-VHPHOLNESA-N
Mol Weight 482.6 g/mol
Molecular Formula C19H31O6PS3
Exact Mass 482.102039 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6CGycxncqp3
Name Diisopropyl 2-(4,5-Dihydroxy-6-methoxy-2-methylsulfanyl-3-phentylsulfanyltetrahydrothiapyranyl)phosphonate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H31O6PS3
InChI InChI=1S/C19H31O6PS3/c1-12(2)24-26(22,25-13(3)4)19(27-6)17(28-14-10-8-7-9-11-14)15(20)16(21)18(23-5)29-19/h7-13,15-18,20-21H,1-6H3/t15-,16+,17+,18+,19-/m0/s1
InChIKey NGPXHJPPXVIBIF-VHPHOLNESA-N
Molecular Weight 482.605 g/mol
SMILES O[C@]1([C@]([C@@](S[C@@]([C@@]1(Sc1ccccc1)[H])(P(OC(C)C)(OC(C)C)=O)SC)(OC)[H])(O)[H])[H]
SPLASH splash10-00kp-9552000000-c119f2795617ae85b12c
Source of Spectrum K1-2004-171-22
Wiley ID 1560068