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6-METHYLHEPTYL-SULFATE

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6-METHYLHEPTYL-SULFATE
SpectraBase Compound ID EInN579DDfb
InChI InChI=1S/C8H18O4S/c1-8(2)6-4-3-5-7-12-13(9,10)11/h8H,3-7H2,1-2H3,(H,9,10,11)/p-1
InChIKey VOXCUZGLPPXOHV-UHFFFAOYSA-M
Mol Weight 209.28 g/mol
Molecular Formula C8H17O4S
Exact Mass 209.084755 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KtkX6WLRQCC
Name 6-METHYLHEPTYL-SULFATE
Compound Number 2A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C8H17O4S
InChI InChI=1S/C8H18O4S/c1-8(2)6-4-3-5-7-12-13(9,10)11/h8H,3-7H2,1-2H3,(H,9,10,11)/p-1
InChIKey VOXCUZGLPPXOHV-UHFFFAOYSA-M
Literature Reference Author A.AIELLO,S.CARBONELLI,G.ESPOSITO,E.FATTORUSSO,T.IUVONE,M.MEN NA
Literature Reference Citation J.NAT.PROD.,63,1590(2000)
Literature Reference DOI 10.1021/np000281o
Molecular Weight 209.281 g/mol
Solvent CD3OD
Source File Reference UWRU8680