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2H-1-Benzopyran-2,5(3H)-dione, 4,6,7,8-tetrahydro-7,7-dimethyl-4-(4-nitrophenyl)-
SpectraBase Compound ID BBnDwcIMCM8
InChI InChI=1S/C17H17NO5/c1-17(2)8-13(19)16-12(7-15(20)23-14(16)9-17)10-3-5-11(6-4-10)18(21)22/h3-6,12H,7-9H2,1-2H3
InChIKey LISDJFGTPKQELX-UHFFFAOYSA-N
Mol Weight 315.33 g/mol
Molecular Formula C17H17NO5
Exact Mass 315.110673 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DQ7mP7qXx45
Name 2H-1-Benzopyran-2,5(3H)-dione, 4,6,7,8-tetrahydro-7,7-dimethyl-4-(4-nitrophenyl)-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H17NO5
InChI InChI=1S/C17H17NO5/c1-17(2)8-13(19)16-12(7-15(20)23-14(16)9-17)10-3-5-11(6-4-10)18(21)22/h3-6,12H,7-9H2,1-2H3
InChIKey LISDJFGTPKQELX-UHFFFAOYSA-N
Molecular Weight 315.325 g/mol
SMILES C12=C(C(CC(C2)(C)C)=O)C(CC(O1)=O)c1ccc(cc1)N(=O)=O
SPLASH splash10-000i-2491000000-e1922a0737a985599c0b
Source of Spectrum IY-1-4469-6
Synonyms 7,7-Dimethyl-4-(4-nitrophenyl)-3,4,6,8-tetrahydro-1-benzopyran-2,5-dione 7,7-Dimethyl-4-(4-nitrophenyl)-3,4,6,8-tetrahydrochromene-2,5-dione
Wiley ID 1652679