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tert-butyl 6-[4-tert-Butoxycarbonyl)-piperazin-1-yl]-1H-benzimidazole-1-carboxylate
SpectraBase Compound ID 518uJdROInX
InChI InChI=1S/C21H30N4O4/c1-20(2,3)28-18(26)24-11-9-23(10-12-24)15-7-8-16-17(13-15)25(14-22-16)19(27)29-21(4,5)6/h7-8,13-14H,9-12H2,1-6H3
InChIKey PGSUYDQHMLEASQ-UHFFFAOYSA-N
Mol Weight 402.5 g/mol
Molecular Formula C21H30N4O4
Exact Mass 402.226705 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 65TU5QuvC8N
Name tert-butyl 6-[4-tert-Butoxycarbonyl)-piperazin-1-yl]-1H-benzimidazole-1-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H30N4O4
InChI InChI=1S/C21H30N4O4/c1-20(2,3)28-18(26)24-11-9-23(10-12-24)15-7-8-16-17(13-15)25(14-22-16)19(27)29-21(4,5)6/h7-8,13-14H,9-12H2,1-6H3
InChIKey PGSUYDQHMLEASQ-UHFFFAOYSA-N
Instrument Name HP 5989 A
Ionization Type EI
Literature Reference DOI 10.1021/jm901672k
Molecular Weight 402.495 g/mol
SMILES c1cc2c(cc1N1CCN(CC1)C(OC(C)(C)C)=O)[n](cn2)C(OC(C)(C)C)=O
SPLASH splash10-0007-4093000000-ac67c88a483bef2bd637
Source of Spectrum AF-53-1365-44-2
Wiley ID 1846349