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1,4-Bis(pentanoyl)cubane
SpectraBase Compound ID G1ubSqwdyCC
InChI InChI=1S/C18H24O2/c1-3-5-7-9(19)17-11-14-12(17)16-13(17)15(11)18(14,16)10(20)8-6-4-2/h11-16H,3-8H2,1-2H3
InChIKey XOIIUJUWRTZDBE-UHFFFAOYSA-N
Mol Weight 272.39 g/mol
Molecular Formula C18H24O2
Exact Mass 272.17763 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5ULeEquNPhz
Name 1,4-Bis(pentanoyl)cubane
Alternate Name(s) 1-(4-pentanoylpentacyclo[4.2.0.0(2,5).0(3,8).0(4,7)]oct-1-yl)-1-pentanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H24O2
InChI InChI=1S/C18H24O2/c1-3-5-7-9(19)17-11-14-12(17)16-13(17)15(11)18(14,16)10(20)8-6-4-2/h11-16H,3-8H2,1-2H3
InChIKey XOIIUJUWRTZDBE-UHFFFAOYSA-N
Molecular Weight 272.388 g/mol
SMILES C12(C3C4C2C2C4(C(=O)CCCC)C3C12)C(=O)CCCC
SPLASH splash10-059j-7930000000-15086977377006b8cf20
Source of Spectrum J-56-5142-16
Wiley ID 1276615