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Harmaline hydrochloride dihydrate

View entire compound with spectra: 2 NMR, 1 FTIR, and 1 Raman

Harmaline hydrochloride dihydrate
SpectraBase Compound ID 2Ujp7TDdKVf
InChI InChI=1S/C13H14N2O.Cl.2H2O/c1-8-13-11(5-6-14-8)10-4-3-9(16-2)7-12(10)15-13;;;/h3-4,7,15H,5-6H2,1-2H3;;2*1H2
InChIKey ZEUKDZYEYXSGSC-UHFFFAOYSA-N
Mol Weight 285.751 g/mol
Molecular Formula C13H18ClN2O3
Exact Mass 285.100595 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID GICLH1H6Bpv
Name Harmaline hydrochloride dihydrate
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number H109
CAS Registry Number 6027-98-1
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18ClN2O3
InChI InChI=1S/C13H14N2O.Cl.2H2O/c1-8-13-11(5-6-14-8)10-4-3-9(16-2)7-12(10)15-13;;;/h3-4,7,15H,5-6H2,1-2H3;;2*1H2
InChIKey ZEUKDZYEYXSGSC-UHFFFAOYSA-N
Observed nucleus 13C
Solvent DMSO-d6
Source of Spectrum Sigma-Aldrich Co. LLC.
Wiley ID SIAL_13CNMR_011973