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8-chloranyl-2,2,7-trimethyl-5-oxidanyl-chromene-6-carbaldehyde
SpectraBase Compound ID B4mHY0SRCmc
InChI InChI=1S/C13H13ClO3/c1-7-9(6-15)11(16)8-4-5-13(2,3)17-12(8)10(7)14/h4-6,16H,1-3H3
InChIKey VEMBFAMASILPGD-UHFFFAOYSA-N
Mol Weight 252.7 g/mol
Molecular Formula C13H13ClO3
Exact Mass 252.055322 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AUfSjrG1IHn
Name 8-chloranyl-2,2,7-trimethyl-5-oxidanyl-chromene-6-carbaldehyde
Comments Less than 3 mono-isotopic peaks
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Formula C13H13ClO3
InChI InChI=1S/C13H13ClO3/c1-7-9(6-15)11(16)8-4-5-13(2,3)17-12(8)10(7)14/h4-6,16H,1-3H3
InChIKey VEMBFAMASILPGD-UHFFFAOYSA-N
Molecular Weight 252.697 g/mol
SMILES Oc1c2c(c(c(c1C=O)C)Cl)OC(C=C2)(C)C
SPLASH splash10-000i-0090000000-eedee230502e3cab36aa
Source of Spectrum AJ-67-1184-33
Synonyms 8-chloro-5-hydroxy-2,2,7-trimethyl-1-benzopyran-6-carboxaldehyde 8-chloro-5-hydroxy-2,2,7-trimethyl-chromene-6-carbaldehyde
Wiley ID 772676