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Telenzepine dihydrochloride hydrate
SpectraBase Compound ID 4lwOPFEPLf
InChI InChI=1S/C19H22N4O2S.2ClH.H2O/c1-13-18-14(12-26-13)19(25)20-15-5-3-4-6-16(15)23(18)17(24)11-22-9-7-21(2)8-10-22;;;/h3-6,12H,7-11H2,1-2H3,(H,20,25);2*1H;1H2
InChIKey HZWCRPGARSMPNS-UHFFFAOYSA-N
Mol Weight 461.408 g/mol
Molecular Formula C19H26Cl2N4O3S
Exact Mass 460.110267 g/mol

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

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SpectraBase Spectrum ID 3PEGunH2wmp
Name Telenzepine dihydrochloride
Source of Sample Sigma-Aldrich Inc.
Catalog Number T122
Lot Number 037K4611
Accessory DurasamplIR II
CAS Registry Number 147416-96-4 (anhydrous)
Compound Type Pure
Copyright Copyright © 2012-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H26Cl2N4O3S
InChI InChI=1S/C19H22N4O2S.2ClH.H2O/c1-13-18-14(12-26-13)19(25)20-15-5-3-4-6-16(15)23(18)17(24)11-22-9-7-21(2)8-10-22;;;/h3-6,12H,7-11H2,1-2H3,(H,20,25);2*1H;1H2
InChIKey HZWCRPGARSMPNS-UHFFFAOYSA-N
Instrument Name Bio-Rad FTS
SMILES c12N(c3c(scc3C(Nc1cccc2)=O)C)C(=O)CN1CCN(CC1)C.Cl.Cl.O
Sample Comments unspecified degree of hydration
Source of Spectrum Forensic Spectral Research
Synonyms 4,9-Dihydro-3-methyl-4-[(4-methyl-1-piperazinyl)acetyl]-10H-thieno[3,4-b][1,5]benzodiazepin-10-one dihydrochloride
Technique ATR-Neat (DuraSamplIR II)