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Pipazethate
SpectraBase Compound ID LSbKDWCJrFK
InChI InChI=1S/C21H25N3O3S/c25-21(27-16-15-26-14-13-23-11-4-1-5-12-23)24-17-7-2-3-8-18(17)28-19-9-6-10-22-20(19)24/h2-3,6-10H,1,4-5,11-16H2
InChIKey DTVJXCOMJLLMAK-UHFFFAOYSA-N
Mol Weight 399.51 g/mol
Molecular Formula C21H25N3O3S
Exact Mass 399.161663 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JGEpKQz8Qme
Name Pipazethate
CAS Registry Number 2167-85-3
Classification Pharmaceutical drug, antitussive
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 399.161662848 u
Formula C21H25N3O3S
InChI InChI=1S/C21H25N3O3S/c25-21(27-16-15-26-14-13-23-11-4-1-5-12-23)24-17-7-2-3-8-18(17)28-19-9-6-10-22-20(19)24/h2-3,6-10H,1,4-5,11-16H2
InChIKey DTVJXCOMJLLMAK-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 399.509 g/mol
Nominal Mass 399 u
Quality 941
SMILES C=12N(C3=C(SC2=CC=CC1)C=CC=N3)C(OCCOCCN1CCCCC1)=O
SPLASH splash10-0002-9510000000-a5c5928efdf31efe4e1c
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Pipazetate Theratuss 2-(2-Piperidin-1-ylethoxy)ethyl-pyrido[3,2-b][1,4]benzothiazine-10-carboxylate
Technique DI/MS
Wiley ID DD2024_007898