For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

5-Methyl resorcinol monohydrate

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

5-Methyl resorcinol monohydrate
SpectraBase Compound ID ChAzNO9tFfR
InChI InChI=1S/C7H8O2.H2O/c1-5-2-6(8)4-7(9)3-5;/h2-4,8-9H,1H3;1H2
InChIKey NBKPNAMTHBIMLA-UHFFFAOYSA-N
Mol Weight 142.154 g/mol
Molecular Formula C7H10O3
Exact Mass 142.062994 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

Subscribe to view the full spectrum.

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 3EhA7MQfVJO
Name Orcinol monohydrate
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number O8208
CAS Registry Number 6153-39-5
Copyright Copyright © 2021-2025 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H8O3
InChI 1S/C7H8O2.H2O/c1-5-2-6(8)4-7(9)3-5;/h2-4,8-9H,1H3;1H2
InChIKey NBKPNAMTHBIMLA-UHFFFAOYSA-N
Observed nucleus 1H
Purity 97%
Solvent CDCl3 & DMSO-d6
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms 3,5-Dihydroxytoluene; 5-Methylresorcinol
Wiley ID SIAL_1HNMR_012448