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Cyclothiazide

View entire compound with spectra: 4 FTIR, and 3 MS (GC)

Cyclothiazide
SpectraBase Compound ID GKNyhcZcgI8
InChI InChI=1S/C14H16ClN3O4S2/c15-10-5-11-13(6-12(10)23(16,19)20)24(21,22)18-14(17-11)9-4-7-1-2-8(9)3-7/h1-2,5-9,14,17-18H,3-4H2,(H2,16,19,20)
InChIKey BOCUKUHCLICSIY-UHFFFAOYSA-N
Mol Weight 389.87 g/mol
Molecular Formula C14H16ClN3O4S2
Exact Mass 389.027076 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Iyqdxfv26y5
Name CYCLOTHIAZIDE
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C14H16ClN3O4S2
InChI InChI=1S/C14H16ClN3O4S2/c15-10-5-11-13(6-12(10)23(16,19)20)24(21,22)18-14(17-11)9-4-7-1-2-8(9)3-7/h1-2,5-9,14,17-18H,3-4H2,(H2,16,19,20)
InChIKey BOCUKUHCLICSIY-UHFFFAOYSA-N
Instrument Name DI
Molecular Weight 389.872 g/mol
SMILES N1C(C2CC3CC2C=C3)NS(=O)(=O)c2c1cc(Cl)c(S(N)(=O)=O)c2
SPLASH splash10-014r-9310000000-9545e801d2f291350e28
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany