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3-Undecyl-3,4-dihydro-1H-2-benzopyran-1-one
SpectraBase Compound ID GrP7tdTQ2uY
InChI InChI=1S/C20H30O2/c1-2-3-4-5-6-7-8-9-10-14-18-16-17-13-11-12-15-19(17)20(21)22-18/h11-13,15,18H,2-10,14,16H2,1H3
InChIKey VJQROBIGBBHPEH-UHFFFAOYSA-N
Mol Weight 302.46 g/mol
Molecular Formula C20H30O2
Exact Mass 302.22458 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CaSNkwYbH2N
Name 3-Undecyl-3,4-dihydro-1H-2-benzopyran-1-one
Alternate Name(s) 3-Undecyl-3,4-dihydroisochromen-1-one 3-Undecylisochroman-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H30O2
InChI InChI=1S/C20H30O2/c1-2-3-4-5-6-7-8-9-10-14-18-16-17-13-11-12-15-19(17)20(21)22-18/h11-13,15,18H,2-10,14,16H2,1H3
InChIKey VJQROBIGBBHPEH-UHFFFAOYSA-N
Molecular Weight 302.458 g/mol
SMILES C1(=O)OC(Cc2ccccc12)CCCCCCCCCCC
SPLASH splash10-014j-2901000000-a555d694311b423adf59
Source of Spectrum CF-19-325-1
Wiley ID 1556902