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

*Links on SpectraBase are not permalinks.
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

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

Attenuated Total Reflectance Infrared (ATR-IR) Spectrum

View the Full Spectrum for FREE!

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

SpectraBase Spectrum ID CQDFE4OybCh
Name Cyclothiazide
Source of Sample Cayman Chemical Company
Catalog Number 16335
Lot Number 0503630-1
Accessory DurasamplIR II
Apodization Function Triangular
CAS Registry Number 2259-96-3
Copyright Copyright © 2019-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H16ClN3O4S2
IUPAC Name 1,​1-​Dioxide 3-​bicyclo[2.2.1]​hept-​5-​en-​2-​yl-​6-​chloro-​3,​4-​dihydro-2H-​1,​2,​4-​benzothiadiazine-​7-​sulfonamide
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 Bio-Rad FTS
SMILES N1S(c2cc(S(=O)(=O)N)c(cc2NC1C1C2\C=C/C(C1)C2)Cl)(=O)=O
Scan Speed (number) 5
Source of Spectrum Forensic Spectral Research
Synonyms Doburil
Technique ATR-Neat