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2-(benzyloxy)-3-nitro-4-[4-(2-methoxyphenylpiperazino)carbonyl]toluene
SpectraBase Compound ID J3FbriY8okA
InChI InChI=1S/C26H27N3O5/c1-19-12-13-21(25(29(31)32)22(19)18-34-20-8-4-3-5-9-20)26(30)28-16-14-27(15-17-28)23-10-6-7-11-24(23)33-2/h3-13H,14-18H2,1-2H3
InChIKey NDEJNXLXPMLNRF-UHFFFAOYSA-N
Mol Weight 461.52 g/mol
Molecular Formula C26H27N3O5
Exact Mass 461.195071 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CDdRWzj4lr8
Name 2-(BENZYLOXY)-3-NITRO-4-[4-(2-METHOXYPHENYLPIPERAZINO)CARBONYL]TOLUENE
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C26H27N3O5
InChI InChI=1S/C26H27N3O5/c1-19-12-13-21(25(29(31)32)22(19)18-34-20-8-4-3-5-9-20)26(30)28-16-14-27(15-17-28)23-10-6-7-11-24(23)33-2/h3-13H,14-18H2,1-2H3
InChIKey NDEJNXLXPMLNRF-UHFFFAOYSA-N
Molecular Weight 461.1944
SMILES c1(C(N2CCN(c3ccccc3OC)CC2)=O)c(N(=O)=O)c(COc2ccccc2)c(C)cc1
SPLASH splash10-0006-9200000000-14a7d047842c4f3a6ba2
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany