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5-Oxo-7,7-dimethyl-5,6,7,8-tetrahydrocoumarin
SpectraBase Compound ID CCA0PZJOqF1
InChI InChI=1S/C11H12O3/c1-11(2)5-8(12)7-3-4-10(13)14-9(7)6-11/h3-4H,5-6H2,1-2H3
InChIKey QWSQWEYOXUONMP-UHFFFAOYSA-N
Mol Weight 192.21 g/mol
Molecular Formula C11H12O3
Exact Mass 192.078644 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7JdA7asvq2M
Name 5-Oxo-7,7-dimethyl-5,6,7,8-tetrahydrocoumarin
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H12O3
InChI InChI=1S/C11H12O3/c1-11(2)5-8(12)7-3-4-10(13)14-9(7)6-11/h3-4H,5-6H2,1-2H3
InChIKey QWSQWEYOXUONMP-UHFFFAOYSA-N
Molecular Weight 192.214 g/mol
SMILES C12=C(OC(C=C2)=O)CC(CC1=O)(C)C
SPLASH splash10-052u-0900000000-f827a5b9228611d081c6
Source of Spectrum HC-23-1176-0
Synonyms 5-Oxo-7,7-dimethyl-5,6,7,8-tetrahydrocoumrin 7,7-Dimethyl-7,8-dihydro-2H-chromene-2,5(6H)-dione
Wiley ID 1188404