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PROGLUMETACIN-ARTIFACT 4
SpectraBase Compound ID IDIonkOYwO9
InChI InChI=1S/C28H32ClN3O4/c1-4-11-30-12-14-31(15-13-30)16-17-36-27(33)19-24-20(2)32(26-10-9-23(35-3)18-25(24)26)28(34)21-5-7-22(29)8-6-21/h4-10,18H,1,11-17,19H2,2-3H3
InChIKey ZBCHJMBRVAOOCG-UHFFFAOYSA-N
Mol Weight 510.0 g/mol
Molecular Formula C28H32ClN3O4
Exact Mass 509.208134 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 85nPkPD0sO6
Name PROGLUMETACIN-ARTIFACT 4
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C28H32ClN3O4
InChI InChI=1S/C28H32ClN3O4/c1-4-11-30-12-14-31(15-13-30)16-17-36-27(33)19-24-20(2)32(26-10-9-23(35-3)18-25(24)26)28(34)21-5-7-22(29)8-6-21/h4-10,18H,1,11-17,19H2,2-3H3
InChIKey ZBCHJMBRVAOOCG-UHFFFAOYSA-N
Instrument Name GC
Molecular Weight 510.034 g/mol
SMILES c1(ccc(C([n]2c3ccc(OC)cc3c(CC(OCCN3CCN(CC=C)CC3)=O)c2C)=O)cc1)Cl
SPLASH splash10-0abl-5910000000-36e725b362f57dc6991d
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany