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7-Chloro-3-methyl-1H-isochromen-1-one

View entire compound with spectra: 1 MS (GC)

7-Chloro-3-methyl-1H-isochromen-1-one
SpectraBase Compound ID LBBIMQM4khc
InChI InChI=1S/C10H7ClO2/c1-6-4-7-2-3-8(11)5-9(7)10(12)13-6/h2-5H,1H3
InChIKey LCIYLYFDEFKCDF-UHFFFAOYSA-N
Mol Weight 194.62 g/mol
Molecular Formula C10H7ClO2
Exact Mass 194.013457 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B2NDCGJsdE0
Name 7-Chloro-3-methyl-1H-isochromen-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H7ClO2
InChI InChI=1S/C10H7ClO2/c1-6-4-7-2-3-8(11)5-9(7)10(12)13-6/h2-5H,1H3
InChIKey LCIYLYFDEFKCDF-UHFFFAOYSA-N
Literature Reference DOI 10.1021/jo300501j
Molecular Weight 194.617 g/mol
SMILES c1(ccc2C=C(OC(c2c1)=O)C)Cl
SPLASH splash10-0006-0900000000-36278176f54c4f7b6068
Source of Spectrum J-77-5027-3j
Synonyms 7-Chloro-3-methyl-2-benzopyran-1-one 7-Chloro-3-methylisochromen-1-one 7-Chloro-3-methyl-isochromen-1-one 7-Chloranyl-3-methyl-isochromen-1-one
Wiley ID 1745115