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4-(5-tert-butyl-2-furanyl)-3-(4,4-dimethyl-3-oxopentyl)-2-benzopyran-1-one
SpectraBase Compound ID 7t7JO9dxmIC
InChI InChI=1S/C24H28O4/c1-23(2,3)19(25)13-11-18-21(17-12-14-20(27-17)24(4,5)6)15-9-7-8-10-16(15)22(26)28-18/h7-10,12,14H,11,13H2,1-6H3
InChIKey KEZIQLZUJCOCMQ-UHFFFAOYSA-N
Mol Weight 380.48 g/mol
Molecular Formula C24H28O4
Exact Mass 380.198759 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CQrnW1WVcvT
Name 4-(5-tert-butyl-2-furanyl)-3-(4,4-dimethyl-3-oxopentyl)-2-benzopyran-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H28O4
InChI InChI=1S/C24H28O4/c1-23(2,3)19(25)13-11-18-21(17-12-14-20(27-17)24(4,5)6)15-9-7-8-10-16(15)22(26)28-18/h7-10,12,14H,11,13H2,1-6H3
InChIKey KEZIQLZUJCOCMQ-UHFFFAOYSA-N
Molecular Weight 380.484 g/mol
SMILES C1(c2oc(C(C)(C)C)cc2)=C(OC(c2c1cccc2)=O)CCC(C(C)(C)C)=O
SPLASH splash10-05fr-7009000000-7c2d9f45312fb4daefda
Source of Spectrum AJ-43-1201-6
Synonyms 4-(5-tert-butyl-2-furyl)-3-(3-keto-4,4-dimethyl-pentyl)isocoumarin 4-(5-tert-butyl-2-furyl)-3-(4,4-dimethyl-3-oxo-pentyl)isochromen-1-one 4-(5-tert-butylfuran-2-yl)-3-(4,4-dimethyl-3-oxidanylidene-pentyl)isochromen-1-one 4-(5-tert-butylfuran-2-yl)-3-(4,4-dimethyl-3-oxopentyl)isochromen-1-one
Wiley ID 1594284