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Cyclopentanecarboxylic acid, 2-(3,4-dihydro-7-methoxy-4-oxo-2H-1-benzopyran-3-yl)-1-methyl-, ethyl ester, (1.alpha.,2.alpha.)-(.+-.)-

View entire compound with spectra: 1 MS (GC)

Cyclopentanecarboxylic acid, 2-(3,4-dihydro-7-methoxy-4-oxo-2H-1-benzopyran-3-yl)-1-methyl-, ethyl ester, (1.alpha.,2.alpha.)-(.+-.)-
SpectraBase Compound ID BL1wlYuQNv4
InChI InChI=1S/C19H24O5/c1-4-23-18(21)19(2)9-5-6-15(19)14-11-24-16-10-12(22-3)7-8-13(16)17(14)20/h7-8,10,14-15H,4-6,9,11H2,1-3H3/t14?,15-,19-/m0/s1
InChIKey IXEYYMRVDPYZLD-KDBUZZBASA-N
Mol Weight 332.4 g/mol
Molecular Formula C19H24O5
Exact Mass 332.162374 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ahwsr8oieF1
Name Cyclopentanecarboxylic acid, 2-(3,4-dihydro-7-methoxy-4-oxo-2H-1-benzopyran-3-yl)-1-methyl-, ethyl ester, (1.alpha.,2.alpha.)-(.+-.)-
Alternate Name(s) Ethyl (1S,2S)-2-(7-methoxy-4-oxo-3,4-dihydro-2H-chromen-3-yl)-1-methylcyclopentanecarboxylate Ethyl c-2-(3',4'-dihydro-7'-methoxy-4'-oxo-2'h-1-benzopyran-3'-yl)-t-1-methylcyclopentane-r-1-carboxylate
CAS Registry Number 70433-39-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H24O5
InChI InChI=1S/C19H24O5/c1-4-23-18(21)19(2)9-5-6-15(19)14-11-24-16-10-12(22-3)7-8-13(16)17(14)20/h7-8,10,14-15H,4-6,9,11H2,1-3H3/t14?,15-,19-/m0/s1
InChIKey IXEYYMRVDPYZLD-KDBUZZBASA-N
Molecular Weight 332.396 g/mol
SMILES C1(C([C@]2([C@@](C(=O)OCC)(CCC2)C)[H])COc2c1ccc(OC)c2)=O
SPLASH splash10-004i-3910000000-68e138c460b3429965bb
Source of Spectrum B-32-377-0
Wiley ID 1329467