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p-Hydroxy-isoptin

View entire compound with spectra: 3 MS (GC)

p-Hydroxy-isoptin
SpectraBase Compound ID KnMKNzwlF8S
InChI InChI=1S/C26H36N2O4/c1-19(2)26(18-27,21-9-10-22(29)24(17-21)31-5)13-7-14-28(3)15-12-20-8-11-23(30-4)25(16-20)32-6/h8-11,16-17,19,29H,7,12-15H2,1-6H3
InChIKey WLKVZSXOMGNZLB-UHFFFAOYSA-N
Mol Weight 440.6 g/mol
Molecular Formula C26H36N2O4
Exact Mass 440.267508 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Hrq8UFCpdAw
Name p-HYDROXYISOPTIN
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C26H36N2O4
InChI InChI=1S/C26H36N2O4/c1-19(2)26(18-27,21-9-10-22(29)24(17-21)31-5)13-7-14-28(3)15-12-20-8-11-23(30-4)25(16-20)32-6/h8-11,16-17,19,29H,7,12-15H2,1-6H3
InChIKey WLKVZSXOMGNZLB-UHFFFAOYSA-N
Molecular Weight 440.2666
SMILES Oc1c(OC)cc(C(CCCN(CCc2ccc(OC)c(OC)c2)C)(C#N)C(C)C)cc1
SPLASH splash10-0553-9340000000-be711ad42165ad8b1c8b
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany