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2-Iodo-5,5-dimethyl-5,6-dihydro-1,3-benzothiazol-7(4H)-one
SpectraBase Compound ID CLMhG963WCh
InChI InChI=1S/C9H10INOS/c1-9(2)3-5-7(6(12)4-9)13-8(10)11-5/h3-4H2,1-2H3
InChIKey XEMKJWXJFNPXSE-UHFFFAOYSA-N
Mol Weight 307.15 g/mol
Molecular Formula C9H10INOS
Exact Mass 306.95278 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9XldZqtniNU
Name 2-Iodo-5,5-dimethyl-5,6-dihydro-1,3-benzothiazol-7(4H)-one
CAS Registry Number 10513-27-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H10INOS
InChI InChI=1S/C9H10INOS/c1-9(2)3-5-7(6(12)4-9)13-8(10)11-5/h3-4H2,1-2H3
InChIKey XEMKJWXJFNPXSE-UHFFFAOYSA-N
Molecular Weight 307.149 g/mol
SMILES c12c(nc(s2)I)CC(CC1=O)(C)C
SPLASH splash10-0zfr-9287000000-66d9083d39a59568bdb8
Source of Spectrum NP-10-4789-0
Synonyms 2-Iodo-5,5-dimethyl-5,6-dihydro-4H-benzothiazol-7-one 2-iodanyl-5,5-dimethyl-4,6-dihydro-1,3-benzothiazol-7-one
Wiley ID 1108926