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2,4,6-trimethylquinoline, sulfate, hydrate

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2,4,6-trimethylquinoline, sulfate, hydrate
SpectraBase Compound ID KWiqz2eBLQs
InChI InChI=1S/C12H13N.H2O4S.H2O/c1-8-4-5-12-11(6-8)9(2)7-10(3)13-12;1-5(2,3)4;/h4-7H,1-3H3;(H2,1,2,3,4);1H2
InChIKey NNYIXPZWAGXBSI-UHFFFAOYSA-N
Mol Weight 287.33 g/mol
Molecular Formula C12H17NO5S
Exact Mass 287.082744 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GF3ODoKzrKi
Name 2,4,6-trimethylquinoline, sulfate, hydrate
Source of Sample Aldrich Chemical Company, Inc., Milwaukee, Wisconsin
Copyright Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H17NO5S
InChI InChI=1S/C12H13N.H2O4S.H2O/c1-8-4-5-12-11(6-8)9(2)7-10(3)13-12;1-5(2,3)4;/h4-7H,1-3H3;(H2,1,2,3,4);1H2
InChIKey NNYIXPZWAGXBSI-UHFFFAOYSA-N
Instrument Name Varian A-60
Sadtler NMR Number 2664M
Solvent D2O
Synonyms QUINOLINE, 2,4,6-TRIMETHYL-, SULFATE, HYDRATE