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anti-(Ra*,2'S*)-N,N'-Bis(4-heptyl)-2-(2'-benzyl-3'-methylbutoyl)-1-naphthamide
SpectraBase Compound ID 93pffj6VAKJ
InChI InChI=1S/C37H51NO2/c1-7-16-30(17-8-2)38(31(18-9-3)19-10-4)37(40)35-32-23-15-14-22-29(32)24-25-33(35)36(39)34(27(5)6)26-28-20-12-11-13-21-28/h11-15,20-25,27,30-31,34H,7-10,16-19,26H2,1-6H3/t34-/m0/s1
InChIKey YEAUPFLQBDMMHB-UMSFTDKQSA-N
Mol Weight 541.8 g/mol
Molecular Formula C37H51NO2
Exact Mass 541.39198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7TOcqFpwUaJ
Name anti-(Ra*,2'S*)-N,N'-Bis(4-heptyl)-2-(2'-benzyl-3'-methylbutoyl)-1-naphthamide
Alternate Name(s) anti-(Ra*,2'S*)-N,N-Bis-4-heptyl-2-(2'-benzyl-3'-methyl-butoyl)-1-naphthamide
Comments Removed - unrepairable contamination (CH2Cl2)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C37H51NO2
InChI InChI=1S/C37H51NO2/c1-7-16-30(17-8-2)38(31(18-9-3)19-10-4)37(40)35-32-23-15-14-22-29(32)24-25-33(35)36(39)34(27(5)6)26-28-20-12-11-13-21-28/h11-15,20-25,27,30-31,34H,7-10,16-19,26H2,1-6H3/t34-/m0/s1
InChIKey YEAUPFLQBDMMHB-UMSFTDKQSA-N
Molecular Weight 541.820 g/mol
SMILES C(c1c(C([C@@](Cc2ccccc2)(C(C)C)[H])=O)ccc2c1cccc2)(N(C(CCC)CCC)C(CCC)CCC)=O
SPLASH splash10-0022-9000000000-37361bd16c5d286d0037
Source of Spectrum KC-0-1359-17
Wiley ID 830575