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4-Azatricyclo[5.2.1.0(2,6)]dec-8-ene-3,5-dione, 4-[4-(2-isopropyl-5-methylphenoxy)phenyl]-
SpectraBase Compound ID 9pvgR7JeNS4
InChI InChI=1S/C25H25NO3/c1-14(2)20-11-4-15(3)12-21(20)29-19-9-7-18(8-10-19)26-24(27)22-16-5-6-17(13-16)23(22)25(26)28/h4-12,14,16-17,22-23H,13H2,1-3H3
InChIKey LFBAZESJCHVKCG-UHFFFAOYSA-N
Mol Weight 387.48 g/mol
Molecular Formula C25H25NO3
Exact Mass 387.183444 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID hUKKctVRhk
Name 4-Azatricyclo[5.2.1.0(2,6)]dec-8-ene-3,5-dione, 4-[4-(2-isopropyl-5-methylphenoxy)phenyl]-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H25NO3
InChI InChI=1S/C25H25NO3/c1-14(2)20-11-4-15(3)12-21(20)29-19-9-7-18(8-10-19)26-24(27)22-16-5-6-17(13-16)23(22)25(26)28/h4-12,14,16-17,22-23H,13H2,1-3H3
InChIKey LFBAZESJCHVKCG-UHFFFAOYSA-N
Molecular Weight 387.479 g/mol
SMILES Cc1cc(Oc2ccc(N3C(C4C5C=CC(C4C3=O)C5)=O)cc2)c(cc1)C(C)C
SPLASH splash10-059i-1109000000-14b1ab2dcb2a38783555
Source of Spectrum AD-0-2532-0
Wiley ID 1422151