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4-(Acetylamino)-N,N-dicyclohexyl-3-nitrobenzamide
SpectraBase Compound ID 7IscRM5tPXj
InChI InChI=1S/C21H29N3O4/c1-15(25)22-19-13-12-16(14-20(19)24(27)28)21(26)23(17-8-4-2-5-9-17)18-10-6-3-7-11-18/h12-14,17-18H,2-11H2,1H3,(H,22,25)
InChIKey BNYUPKUVTGIDHT-UHFFFAOYSA-N
Mol Weight 387.48 g/mol
Molecular Formula C21H29N3O4
Exact Mass 387.215806 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3OhfXuYRlY
Name 4-(Acetylamino)-N,N-dicyclohexyl-3-nitrobenzamide
Alternate Name(s) 4-Acetamido-N,N-dicyclohexyl-3-nitrobenzamide
CAS Registry Number 95004-82-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H29N3O4
InChI InChI=1S/C21H29N3O4/c1-15(25)22-19-13-12-16(14-20(19)24(27)28)21(26)23(17-8-4-2-5-9-17)18-10-6-3-7-11-18/h12-14,17-18H,2-11H2,1H3,(H,22,25)
InChIKey BNYUPKUVTGIDHT-UHFFFAOYSA-N
Molecular Weight 387.480 g/mol
SMILES N(c1c(cc(cc1)C(=O)N(C1CCCCC1)C1CCCCC1)N(=O)=O)C(C)=O
SPLASH splash10-0pvi-3659000000-87265d4887a859e93387
Source of Spectrum NP-14-1191-0
Wiley ID 1111533