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(3-carboxy-3-{[(4-hydroxytetrahydro-2H-pyran-4-yl)methyl]amino}propyl)(dimethyl)sulfonium
SpectraBase Compound ID 56o64rzyssm
InChI InChI=1S/C12H23NO4S/c1-18(2)8-3-10(11(14)15)13-9-12(16)4-6-17-7-5-12/h10,13,16H,3-9H2,1-2H3/p+1
InChIKey DEKCCMBLWQYBDD-UHFFFAOYSA-O
Mol Weight 278.39 g/mol
Molecular Formula C12H24NO4S
Exact Mass 278.142604 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BALoaWxt85u
Name (3-carboxy-3-{[(4-hydroxytetrahydro-2H-pyran-4-yl)methyl]amino}propyl)(dimethyl)sulfonium
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H24NO4S
InChI InChI=1S/C12H23NO4S/c1-18(2)8-3-10(11(14)15)13-9-12(16)4-6-17-7-5-12/h10,13,16H,3-9H2,1-2H3/p+1
InChIKey DEKCCMBLWQYBDD-UHFFFAOYSA-O
Molecular Weight 278.387 g/mol
SMILES N(C(C(=O)O)CC[S+](C)C)CC1(CCOCC1)O
SPLASH splash10-059f-9300000000-7cafa04bda875fcd62d0
Synonyms [3-carboxy-3-[(4-hydroxy-tetrahydro-pyran-4-ylmethyl)-amino]-propyl]-dimethyl-sulfonium
Wiley ID 1452899