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2H,8H-Benzo[1,2-b:3,4-b']dipyran-9-carbonitrile, 3,4-dihydro-2-methoxy-2-methyl-8-oxo-5-pentyl-, (.+-.)-
SpectraBase Compound ID HMdx0CRlcZU
InChI InChI=1S/C20H23NO4/c1-4-5-6-7-13-11-17-16(10-14(12-21)19(22)24-17)18-15(13)8-9-20(2,23-3)25-18/h10-11H,4-9H2,1-3H3
InChIKey NOSWNJYTGIBWSN-UHFFFAOYSA-N
Mol Weight 341.41 g/mol
Molecular Formula C20H23NO4
Exact Mass 341.162708 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AcTOnlGn24t
Name 2H,8H-Benzo[1,2-b:3,4-b']dipyran-9-carbonitrile, 3,4-dihydro-2-methoxy-2-methyl-8-oxo-5-pentyl-, (.+-.)-
CAS Registry Number 81482-17-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H23NO4
InChI InChI=1S/C20H23NO4/c1-4-5-6-7-13-11-17-16(10-14(12-21)19(22)24-17)18-15(13)8-9-20(2,23-3)25-18/h10-11H,4-9H2,1-3H3
InChIKey NOSWNJYTGIBWSN-UHFFFAOYSA-N
Molecular Weight 341.407 g/mol
SMILES c12c3c(CCC(O3)(OC)C)c(cc1OC(=O)C(=C2)C#N)CCCCC
SPLASH splash10-0296-0097000000-55d3324de65b117953d2
Source of Spectrum I-60-313-0
Synonyms 2-Methoxy-2-methyl-8-oxo-5-pentyl-3,4-dihydro-2H,8H-pyrano[2,3-f]chromene-9-carbonitrile 9,8-Dihydro-6-methoxy-6-methyl-2-oxo-7-pentyl-2H,6H-1,5-dioxaphenanthrene-3-carbonitrile
Wiley ID 1335976