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N-(4-methylphenyl)-2,3-tetramethylene-5-(3-
SpectraBase Compound ID G2O7PtnoiAU
InChI InChI=1S/C23H21N3O3S/c1-15-9-11-17(12-10-15)25-22(27)21-19-7-2-3-8-20(19)30-23(21)24-14-16-5-4-6-18(13-16)26(28)29/h4-6,9-14H,2-3,7-8H2,1H3,(H,25,27)/b24-14+
InChIKey XONAEPVMTVFAOA-ZVHZXABRSA-N
Mol Weight 419.5 g/mol
Molecular Formula C23H21N3O3S
Exact Mass 419.130363 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AKVRfL1maas
Name N-(4-METHYLPHENYL)-2,3-TETRAMETHYLENE-5-(3-
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C23H21N3O3S
InChI InChI=1S/C23H21N3O3S/c1-15-9-11-17(12-10-15)25-22(27)21-19-7-2-3-8-20(19)30-23(21)24-14-16-5-4-6-18(13-16)26(28)29/h4-6,9-14H,2-3,7-8H2,1H3,(H,25,27)/b24-14+
InChIKey XONAEPVMTVFAOA-ZVHZXABRSA-N
Molecular Weight 419.1299
SMILES N(c1ccc(C)cc1)C(=O)c1c(\N=C\c2cccc(N(=O)=O)c2)sc2CCCCc12
SPLASH splash10-004i-9521000000-2e867272eb731d96b4ae
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany