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(dl)-3-(Heptadecyl)-3,4-dihydroisocoumarin

View entire compound with spectra: 1 MS (GC)

(dl)-3-(Heptadecyl)-3,4-dihydroisocoumarin
SpectraBase Compound ID DqxOmT8oa01
InChI InChI=1S/C26H42O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20-24-22-23-19-17-18-21-25(23)26(27)28-24/h17-19,21,24H,2-16,20,22H2,1H3
InChIKey SPRYMHJCXUHCLL-UHFFFAOYSA-N
Mol Weight 386.6 g/mol
Molecular Formula C26H42O2
Exact Mass 386.318481 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID eOc0yZq8O
Name (dl)-3-(Heptadecyl)-3,4-dihydroisocoumarin
Alternate Name(s) 3-Heptadecylisochroman-1-one 3-Heptadecyl-3,4-dihydro-1H-2-benzopyran-1-one 3-Heptadecyl-3,4-dihydroisochromen-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H42O2
InChI InChI=1S/C26H42O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20-24-22-23-19-17-18-21-25(23)26(27)28-24/h17-19,21,24H,2-16,20,22H2,1H3
InChIKey SPRYMHJCXUHCLL-UHFFFAOYSA-N
Molecular Weight 386.620 g/mol
SMILES c1ccc2C(OC(Cc2c1)CCCCCCCCCCCCCCCCC)=O
SPLASH splash10-014s-1903000000-1ac78d5b89b7403fb2f2
Source of Spectrum Y1-46B-1326-7a
Wiley ID 1744514