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(P)-Dibutyl[1+1]cycloamide
SpectraBase Compound ID Ihiz1EIX2QB
InChI InChI=1S/C47H50N2O2/c1-9-11-19-47(20-12-10-2)34-21-29(5)43(30(6)22-34)48-45(50)38-25-33-26-39(46(51)49-44-31(7)23-35(47)24-32(44)8)37-18-14-16-28(4)41(37)42(33)40-27(3)15-13-17-36(38)40/h13-18,21-26H,9-12,19-20H2,1-8H3,(H,48,50)(H,49,51)
InChIKey AEQBDKGBUUQFAD-UHFFFAOYSA-N
Mol Weight 674.9 g/mol
Molecular Formula C47H50N2O2
Exact Mass 674.387229 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IuoiyRguDWg
Name (P)-Dibutyl[1+1]cycloamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C47H50N2O2
InChI InChI=1S/C47H50N2O2/c1-9-11-19-47(20-12-10-2)34-21-29(5)43(30(6)22-34)48-45(50)38-25-33-26-39(46(51)49-44-31(7)23-35(47)24-32(44)8)37-18-14-16-28(4)41(37)42(33)40-27(3)15-13-17-36(38)40/h13-18,21-26H,9-12,19-20H2,1-8H3,(H,48,50)(H,49,51)
InChIKey AEQBDKGBUUQFAD-UHFFFAOYSA-N
Molecular Weight 674.929 g/mol
SMILES N1c2c(cc(C(c3cc(c(c(c3)C)NC(c3cc4c(c5c(cccc35)C)c3c(c(C1=O)c4)cccc3C)=O)C)(CCCC)CCCC)cc2C)C
SPLASH splash10-00fr-0000009000-4f8a5ef946ef4974fffc
Source of Spectrum F-55-14863-13
Synonyms 22,22-dibutyl-6,10,19,25,32,35-hexamethyl-17,27-diazaheptacyclo[13.13.3.2(18,21).2(23,26).0(2,7).0(8,30).0(9,14)]pentatriaconta-1,3,5,7,9,11,13,15(31),18,20,23,25,29,32,34-pentadecaene-16,28-dione
Wiley ID 840266