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Inositol

View entire compound with spectra: 12 NMR, 6 FTIR, and 2 Raman

Inositol
SpectraBase Compound ID 1wiFEif8IUn
InChI InChI=1S/C6H12O6/c7-1-2(8)4(10)6(12)5(11)3(1)9/h1-12H/t1-,2-,3-,4+,5-,6-
InChIKey CDAISMWEOUEBRE-GPIVLXJGSA-N
Mol Weight 180.16 g/mol
Molecular Formula C6H12O6
Exact Mass 180.063388 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4Z32s3opp3I
Name myo-Inositol
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number I6652
CAS Registry Number 87-89-8
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H12O6
InChI InChI=1S/C6H12O6/c7-1-2(8)4(10)6(12)5(11)3(1)9/h1-12H/t1-,2-,3-,4+,5-,6-
InChIKey CDAISMWEOUEBRE-GPIVLXJGSA-N
Observed nucleus 13C
Solvent DMSO-d6
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms 1,2,3,4,5,6-Hexahydroxycyclohexane, i-Inositol, meso-Inositol
Wiley ID SIAL_13CNMR_012161