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3-tert-Butyl-3,4-dihydro-1H-2-benzopyran-1-one
SpectraBase Compound ID 1jEm3DCulBs
InChI InChI=1S/C13H16O2/c1-13(2,3)11-8-9-6-4-5-7-10(9)12(14)15-11/h4-7,11H,8H2,1-3H3
InChIKey WYKRFAWMEIQHOO-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 1O0Isy56lWv
Name 3-tert-Butyl-3,4-dihydro-1H-2-benzopyran-1-one
Alternate Name(s) 3-tert-Butyl-3,4-dihydroisochromen-1-one 3-tert-Butylisochroman-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16O2
InChI InChI=1S/C13H16O2/c1-13(2,3)11-8-9-6-4-5-7-10(9)12(14)15-11/h4-7,11H,8H2,1-3H3
InChIKey WYKRFAWMEIQHOO-UHFFFAOYSA-N
Molecular Weight 204.269 g/mol
SMILES C1(OC(C(C)(C)C)Cc2c1cccc2)=O
SPLASH splash10-014j-2900000000-f6bf25e5e8c12c8b6cc1
Source of Spectrum SO-0-1104-5
Wiley ID 1545962