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2-{[1-(3-Methylbut-3-en-1-yl)cyclohexyle]methoxy}isoindoline-1,3-dione
SpectraBase Compound ID Db2BQ4UZiV3
InChI InChI=1S/C20H25NO3/c1-15(2)10-13-20(11-6-3-7-12-20)14-24-21-18(22)16-8-4-5-9-17(16)19(21)23/h4-5,8-9H,1,3,6-7,10-14H2,2H3
InChIKey ZNQKPKJVBCXPLJ-UHFFFAOYSA-N
Mol Weight 327.42 g/mol
Molecular Formula C20H25NO3
Exact Mass 327.183444 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JFynLlxaUo4
Name 2-{[1-(3-Methylbut-3-en-1-yl)cyclohexyle]methoxy}isoindoline-1,3-dione
Appearance Colorless oil
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Formula C20H25NO3
InChI InChI=1S/C20H25NO3/c1-15(2)10-13-20(11-6-3-7-12-20)14-24-21-18(22)16-8-4-5-9-17(16)19(21)23/h4-5,8-9H,1,3,6-7,10-14H2,2H3
InChIKey ZNQKPKJVBCXPLJ-UHFFFAOYSA-N
Instrument Name Shimadzu GCMS-QP2010S
Ionization Type EI
Literature Reference DOI 10.1002/anie.201710895
Molecular Weight 327.424 g/mol
Quality 281
Reported Formula C20H25NO3
SMILES C1CCCC(C1)(CON1C(=O)C2=C(C1=O)C=CC=C2)CCC(C)=C
SPLASH splash10-0ldj-9300000000-2eb166c8fa7fa82a7737
Source of Spectrum ACI-57-SM62-43c (DOI: 10.1002/anie.201710895)
Wiley ID 1890865