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4-(3,4-Dihydro-1H-isochromen-3-yl)butan-2-one

View entire compound with spectra: 1 MS (GC)

4-(3,4-Dihydro-1H-isochromen-3-yl)butan-2-one
SpectraBase Compound ID I1XEJNe47Dy
InChI InChI=1S/C13H16O2/c1-10(14)6-7-13-8-11-4-2-3-5-12(11)9-15-13/h2-5,13H,6-9H2,1H3
InChIKey MPGGYGBKIJUQJA-UHFFFAOYSA-N
Mol Weight 204.27 g/mol
Molecular Formula C13H16O2
Exact Mass 204.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7j88bfgJRUD
Name 4-(3,4-Dihydro-1H-isochromen-3-yl)butan-2-one
Alternate Name(s) 4-(isochroman-3-yl)butan-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16O2
InChI InChI=1S/C13H16O2/c1-10(14)6-7-13-8-11-4-2-3-5-12(11)9-15-13/h2-5,13H,6-9H2,1H3
InChIKey MPGGYGBKIJUQJA-UHFFFAOYSA-N
Literature Reference DOI 10.1002/jccs.200600191
Molecular Weight 204.269 g/mol
SMILES CC(CCC1OCc2ccccc2C1)=O
SPLASH splash10-004i-6900000000-7808e632d8e2243983ab
Source of Spectrum QA-53-1460-17b
Wiley ID 1796249