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Pentanamide, 2-methyl-N,N-bis(1-methylethyl)-4-(phenylthio)-, (R*,S*)-
SpectraBase Compound ID J3FFC3oSvwO
InChI InChI=1S/C18H29NOS/c1-13(2)19(14(3)4)18(20)15(5)12-16(6)21-17-10-8-7-9-11-17/h7-11,13-16H,12H2,1-6H3
InChIKey PSYXHVIHZYIUBX-UHFFFAOYSA-N
Mol Weight 307.5 g/mol
Molecular Formula C18H29NOS
Exact Mass 307.196986 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 36lkj1ZjNWe
Name Pentanamide, 2-methyl-N,N-bis(1-methylethyl)-4-(phenylthio)-, (R*,S*)-
Alternate Name(s) N,N-diisopropyl-2-methyl-4-(phenylsulfanyl)pentanamide N,N-diisopropyl-2-methyl-4-(phenylthio)pentananamide
CAS Registry Number 109640-00-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H29NOS
InChI InChI=1S/C18H29NOS/c1-13(2)19(14(3)4)18(20)15(5)12-16(6)21-17-10-8-7-9-11-17/h7-11,13-16H,12H2,1-6H3
InChIKey PSYXHVIHZYIUBX-UHFFFAOYSA-N
Molecular Weight 307.496 g/mol
SMILES C(N(C(C)C)C(C)C)(C(CC(Sc1ccccc1)C)C)=O
SPLASH splash10-08fr-2900000000-85042d9aadabb432fba3
Source of Spectrum C-109-5412-49
Wiley ID 1309059