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3-(5-hydroxy-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-6-yl)propanoic acid 3-methylbut-2-enyl ester
SpectraBase Compound ID 3BVwb92lkNj
InChI InChI=1S/C19H26O4/c1-13(2)10-12-22-17(20)8-6-14-5-7-16-15(18(14)21)9-11-19(3,4)23-16/h5,7,10,21H,6,8-9,11-12H2,1-4H3
InChIKey SOGFLVRNWUHRMO-UHFFFAOYSA-N
Mol Weight 318.41 g/mol
Molecular Formula C19H26O4
Exact Mass 318.183109 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID qJjLQzD9p6
Name 3-(5-hydroxy-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-6-yl)propanoic acid 3-methylbut-2-enyl ester
Alternate Name(s) 3-(5-hydroxy-2,2-dimethyl-chroman-6-yl)propionic acid 3-methylbut-2-enyl ester 3-Methylbut-2-enyl 3-(2,2-dimethyl-5-oxidanyl-3,4-dihydrochromen-6-yl)propanoate 3-Methylbut-2-enyl 3-(5-hydroxy-2,2-dimethyl-3,4-dihydrochromen-6-yl)propanoate 3-Methylbut-2-enyl 3-(5-hydroxy-2,2-dimethyl-chroman-6-yl)propanoate
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Formula C19H26O4
InChI InChI=1S/C19H26O4/c1-13(2)10-12-22-17(20)8-6-14-5-7-16-15(18(14)21)9-11-19(3,4)23-16/h5,7,10,21H,6,8-9,11-12H2,1-4H3
InChIKey SOGFLVRNWUHRMO-UHFFFAOYSA-N
Molecular Weight 318.413 g/mol
SMILES Oc1c2c(OC(CC2)(C)C)ccc1CCC(=O)OCC=C(C)C
SPLASH splash10-0fbl-0920000000-ed3b449c8c62873d13db
Source of Spectrum F-49-1706-25
Wiley ID 1318662