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UUODOEGHZZBDBL-UHFFFAOYSA-N

View entire compound with spectra: 4 NMR, and 1 MS (GC)

UUODOEGHZZBDBL-UHFFFAOYSA-N
SpectraBase Compound ID 6XKpAr58xvc
InChI InChI=1S/C8H6INS/c1-5-10-7-4-6(9)2-3-8(7)11-5/h2-4H,1H3
InChIKey UUODOEGHZZBDBL-UHFFFAOYSA-N
Mol Weight 275.11 g/mol
Molecular Formula C8H6INS
Exact Mass 274.926565 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G1h3KvqVMsN
Name 5-Iodo-2-methyl-1,3-benzothiazole
Alternate Name(s) 5-iodanyl-2-methyl-1,3-benzothiazole 5-Iodo-2-methyl-benzothiazole
CAS Registry Number 90414-61-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H6INS
InChI InChI=1S/C8H6INS/c1-5-10-7-4-6(9)2-3-8(7)11-5/h2-4H,1H3
InChIKey UUODOEGHZZBDBL-UHFFFAOYSA-N
Molecular Weight 275.107 g/mol
SMILES c12c(nc(s2)C)cc(I)cc1
SPLASH splash10-004i-4390000000-d4290daafbad0d96e323
Wiley ID 1459026