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6-Methyl-3,4-di-n-propyl-1H-isochromen-1-one
SpectraBase Compound ID Cks4cevG6DT
InChI InChI=1S/C16H20O2/c1-4-6-12-14-10-11(3)8-9-13(14)16(17)18-15(12)7-5-2/h8-10H,4-7H2,1-3H3
InChIKey JUNIKPRXSAJRBH-UHFFFAOYSA-N
Mol Weight 244.33 g/mol
Molecular Formula C16H20O2
Exact Mass 244.14633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KjRjEyzCiwz
Name 6-Methyl-3,4-di-n-propyl-1H-isochromen-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H20O2
InChI InChI=1S/C16H20O2/c1-4-6-12-14-10-11(3)8-9-13(14)16(17)18-15(12)7-5-2/h8-10H,4-7H2,1-3H3
InChIKey JUNIKPRXSAJRBH-UHFFFAOYSA-N
Literature Reference DOI 10.1002/anie.201500600
Molecular Weight 244.334 g/mol
SMILES c1c(cc2C(=C(OC(=O)c2c1)CCC)CCC)C
SPLASH splash10-014i-0690000000-4002a107350b42d167da
Source of Spectrum ACI-54-5513/SMS12-3bc
Synonyms 6-Methyl-3,4-dipropyl-1H-isochromen-1-one
Wiley ID 1761154