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Trimethylamine N-oxide dihydrate

View entire compound with spectra: 4 NMR, 3 FTIR, and 1 Raman

Trimethylamine N-oxide dihydrate
SpectraBase Compound ID 72Zy82vqPZv
InChI InChI=1S/C3H9NO.2H2O/c1-4(2,3)5;;/h1-3H3;2*1H2
InChIKey PGFPZGKEDZGJQZ-UHFFFAOYSA-N
Mol Weight 111.141 g/mol
Molecular Formula C3H13NO3
Exact Mass 111.089543 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6lDDRSzcTI9
Name Trimethylamine N-oxide dihydrate
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 176869
CAS Registry Number 62637-93-8
Copyright Copyright © 2021-2025 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C3H13NO3
InChI 1S/C3H9NO.2H2O/c1-4(2,3)5;;/h1-3H3;2*1H2
InChIKey PGFPZGKEDZGJQZ-UHFFFAOYSA-N
Observed nucleus 13C
Purity 98%
Solvent D2O
Source of Spectrum Sigma-Aldrich Co. LLC.
Wiley ID SIAL_13CNMR_002146