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2,2-Dimethyl-6-methoxy-7-mercapto-4-chromanone
SpectraBase Compound ID 6DAC2roEqsj
InChI InChI=1S/C12H14O3S/c1-12(2)6-8(13)7-4-10(14-3)11(16)5-9(7)15-12/h4-5,16H,6H2,1-3H3
InChIKey XAQXISGBFVIPBW-UHFFFAOYSA-N
Mol Weight 238.3 g/mol
Molecular Formula C12H14O3S
Exact Mass 238.066365 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BKZIFWRB8fP
Name 2,2-Dimethyl-6-methoxy-7-mercapto-4-chromanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H14O3S
InChI InChI=1S/C12H14O3S/c1-12(2)6-8(13)7-4-10(14-3)11(16)5-9(7)15-12/h4-5,16H,6H2,1-3H3
InChIKey XAQXISGBFVIPBW-UHFFFAOYSA-N
Molecular Weight 238.301 g/mol
SMILES Sc1c(cc2c(OC(CC2=O)(C)C)c1)OC
SPLASH splash10-008i-0690000000-c090a33719ced3c31c7d
Source of Spectrum SO-0-839-7
Synonyms 6-Methoxy-2,2-dimethyl-7-sulfanyl-2,3-dihydro-4H-chromen-4-one
Wiley ID 1545123