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1-(4-[5-Tetrazolylamino]-carbonyl-phenyl)-2-(1,1,4,4-tetramethyl-tetralinyl-6)-(E)-propene
SpectraBase Compound ID DTtkhWCDXWu
InChI InChI=1S/C25H29N5O/c1-16(19-10-11-20-21(15-19)25(4,5)13-12-24(20,2)3)14-17-6-8-18(9-7-17)22(31)26-23-27-29-30-28-23/h6-11,14-15H,12-13H2,1-5H3,(H2,26,27,28,29,30,31)/b16-14+
InChIKey KZIMNVLACVSPII-JQIJEIRASA-N
Mol Weight 415.54 g/mol
Molecular Formula C25H29N5O
Exact Mass 415.237211 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JwGKINOwsYf
Name 1-(4-[5-Tetrazolylamino]-carbonyl-phenyl)-2-(1,1,4,4-tetramethyl-tetralinyl-6)-(E)-propene
CAS Registry Number 87634-90-0
Comments WHE-7286-20
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C25H29N5O
InChI InChI=1S/C25H29N5O/c1-16(19-10-11-20-21(15-19)25(4,5)13-12-24(20,2)3)14-17-6-8-18(9-7-17)22(31)26-23-27-29-30-28-23/h6-11,14-15H,12-13H2,1-5H3,(H2,26,27,28,29,30,31)/b16-14+
InChIKey KZIMNVLACVSPII-JQIJEIRASA-N
Instrument Name Bruker WP-80
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6