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6-chloranyl-2H-chromene-3-carboxylic acid
SpectraBase Compound ID 125CEYpmIZX
InChI InChI=1S/C10H7ClO3/c11-8-1-2-9-6(4-8)3-7(5-14-9)10(12)13/h1-4H,5H2,(H,12,13)
InChIKey ZRCGKWSNRRTAJY-UHFFFAOYSA-N
Mol Weight 210.62 g/mol
Molecular Formula C10H7ClO3
Exact Mass 210.008372 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1BKu5vxU12r
Name 6-chloranyl-2H-chromene-3-carboxylic acid
CAS Registry Number 83823-06-7
Comments Less than 3 mono-isotopic peaks
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Formula C10H7ClO3
InChI InChI=1S/C10H7ClO3/c11-8-1-2-9-6(4-8)3-7(5-14-9)10(12)13/h1-4H,5H2,(H,12,13)
InChIKey ZRCGKWSNRRTAJY-UHFFFAOYSA-N
Molecular Weight 210.616 g/mol
SMILES OC(C1=Cc2cc(Cl)ccc2OC1)=O
SPLASH splash10-014i-0940000000-b9e5e2fb0fbcdc77fb63
Source of Spectrum QC-6-1006-5
Synonyms 6-chloro-2H-1-benzopyran-3-carboxylic acid 6-Chloro-2H-chromene-3-carboxylic acid
Wiley ID 868796