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Thiazolo[3,2-a]pyridinium, 7-bromo-3-carboxy-2,3-dihydro-8-hydroxy-5-methyl-, hydroxide, inner salt
SpectraBase Compound ID AJi10ibmomd
InChI InChI=1S/C9H8BrNO3S/c1-4-2-5(10)7(12)8-11(4)6(3-15-8)9(13)14/h2,6H,3H2,1H3,(H-,12,13,14)
InChIKey JJRFWZIFINXPBY-UHFFFAOYSA-N
Mol Weight 290.13 g/mol
Molecular Formula C9H8BrNO3S
Exact Mass 288.940827 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4bPeSS2o656
Name Thiazolo[3,2-a]pyridinium, 7-bromo-3-carboxy-2,3-dihydro-8-hydroxy-5-methyl-, hydroxide, inner salt
CAS Registry Number 22989-29-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H8BrNO3S
InChI InChI=1S/C9H8BrNO3S/c1-4-2-5(10)7(12)8-11(4)6(3-15-8)9(13)14/h2,6H,3H2,1H3,(H-,12,13,14)
InChIKey JJRFWZIFINXPBY-UHFFFAOYSA-N
Molecular Weight 290.131 g/mol
SMILES OC(C1[n+]2c(c(c(cc2C)Br)[O-])SC1)=O
SPLASH splash10-0006-9220000000-b1769b9e97eea2989835
Source of Spectrum S-26-2393-12
Synonyms 7-Bromo-3-carboxy-5-methyl-2H,3H-[1,3]thiazolo[3,2-a]pyridin-4-ium-8-olate 7-Bromanyl-3-carboxy-5-methyl-2,3-dihydro-[1,3]thiazolo[3,2-a]pyridin-4-ium-8-olate 7-Bromo-3-carboxy-5-methyl-2,3-dihydro-[1,3]thiazolo[3,2-a]pyridin-4-ium-8-olate 7-Bromo-3-carboxy-5-methyl-2,3-dihydrothiazolo[3,2-a]pyridin-4-ium-8-olate
Wiley ID 1292389