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(1R*,2S*)-N,N-Diisopropyl-2-butyl-1,2-dihydro-1-naphthalenecaroxamide
SpectraBase Compound ID GJkGelSpt00
InChI InChI=1S/C21H31NO/c1-6-7-10-18-14-13-17-11-8-9-12-19(17)20(18)21(23)22(15(2)3)16(4)5/h8-9,11-16,18,20H,6-7,10H2,1-5H3/t18-,20+/m0/s1
InChIKey ININZQHOKVVJFO-AZUAARDMSA-N
Mol Weight 313.49 g/mol
Molecular Formula C21H31NO
Exact Mass 313.240565 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FQ5BGKUXdUK
Name (1R*,2S*)-N,N-Diisopropyl-2-butyl-1,2-dihydro-1-naphthalenecaroxamide
Comments Removed - expert review: contamination (CH2Cl2); A corrected record has been addded having SpectrumID: 1821048
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H31NO
InChI InChI=1S/C21H31NO/c1-6-7-10-18-14-13-17-11-8-9-12-19(17)20(18)21(23)22(15(2)3)16(4)5/h8-9,11-16,18,20H,6-7,10H2,1-5H3/t18-,20+/m0/s1
InChIKey ININZQHOKVVJFO-AZUAARDMSA-N
Molecular Weight 313.485 g/mol
SMILES C([C@]1(c2c(cccc2)C=C[C@@]1(CCCC)[H])[H])(N(C(C)C)C(C)C)=O
SPLASH splash10-000i-9100000000-58a2f3a424e96896250f
Source of Spectrum F-55-14171-12
Synonyms (1R*,2S*)-N,N-Diisopropyl-2-butyl-2-deuterio-1,2-dihydro-1-naphthalenecaroxamide
Wiley ID 840056