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trans-3-Chloro-3,4-dihydro-4-methyl-2H-1-benzopyran-2-one
SpectraBase Compound ID 8sD9YBIFqC6
InChI InChI=1S/C10H9ClO2/c1-6-7-4-2-3-5-8(7)13-10(12)9(6)11/h2-6,9H,1H3/t6-,9+/m0/s1
InChIKey LVVPIAKJKYTVPQ-IMTBSYHQSA-N
Mol Weight 196.63 g/mol
Molecular Formula C10H9ClO2
Exact Mass 196.029107 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Dg1zDC621Ij
Name trans-3-Chloro-3,4-dihydro-4-methyl-2H-1-benzopyran-2-one
Alternate Name(s) (3R,4S)-3-chloro-4-methyl-3,4-dihydro-2H-chromen-2-one
Comments Less than 3 mono-isotopic peaks
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Formula C10H9ClO2
InChI InChI=1S/C10H9ClO2/c1-6-7-4-2-3-5-8(7)13-10(12)9(6)11/h2-6,9H,1H3/t6-,9+/m0/s1
InChIKey LVVPIAKJKYTVPQ-IMTBSYHQSA-N
Molecular Weight 196.633 g/mol
SMILES C1(Oc2ccccc2[C@@]([C@]1(Cl)[H])(C)[H])=O
SPLASH splash10-001j-0900000000-c8576e559eef907ca19c
Source of Spectrum KC-1991-206-4
Wiley ID 1192690