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5-Methoxyisochroman-1-one

View entire compound with spectra: 1 MS (GC)

5-Methoxyisochroman-1-one
SpectraBase Compound ID 2o2akUgPKfr
InChI InChI=1S/C10H10O3/c1-12-9-4-2-3-8-7(9)5-6-13-10(8)11/h2-4H,5-6H2,1H3
InChIKey DAWJRAVKWQWRKL-UHFFFAOYSA-N
Mol Weight 178.19 g/mol
Molecular Formula C10H10O3
Exact Mass 178.062994 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5V11aMdza4u
Name 5-Methoxyisochroman-1-one
Alternate Name(s) 5-Methoxy-3,4-dihydro-1H-2-benzopyran-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H10O3
InChI InChI=1S/C10H10O3/c1-12-9-4-2-3-8-7(9)5-6-13-10(8)11/h2-4H,5-6H2,1H3
InChIKey DAWJRAVKWQWRKL-UHFFFAOYSA-N
Molecular Weight 178.187 g/mol
SMILES C1(c2c(c(OC)ccc2)CCO1)=O
SPLASH splash10-0fb9-1900000000-c6d294b42dda1bc38c73
Source of Spectrum U1-2009-2530-8c
Wiley ID 1663076