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Hexanediamide, N6-methyl-N1,N1-bis(1-methylethyl)-N6-phenyl-2-[(phenylthio)methylene]-, (E)-
SpectraBase Compound ID 7LdzdWDrrip
InChI InChI=1S/C26H34N2O2S/c1-20(2)28(21(3)4)26(30)22(19-31-24-16-10-7-11-17-24)13-12-18-25(29)27(5)23-14-8-6-9-15-23/h6-11,14-17,19-21H,12-13,18H2,1-5H3/b22-19+
InChIKey OJXHEFVAYYGAPE-ZBJSNUHESA-N
Mol Weight 438.6 g/mol
Molecular Formula C26H34N2O2S
Exact Mass 438.2341 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DeM9TK3g0pt
Name Hexanediamide, N6-methyl-N1,N1-bis(1-methylethyl)-N6-phenyl-2-[(phenylthio)methylene]-, (E)-
Alternate Name(s) (2E)-N(1),N(1)-diisopropyl-N(6)-methyl-N(6)-phenyl-2-[(phenylsulfanyl)methylene]hexanediamide (E)-6-(phenylthio)-5-(N,N-diisopropylcarbamoyl-N-methyl-N-phenyl-5-hexenamide
CAS Registry Number 105970-91-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H34N2O2S
InChI InChI=1S/C26H34N2O2S/c1-20(2)28(21(3)4)26(30)22(19-31-24-16-10-7-11-17-24)13-12-18-25(29)27(5)23-14-8-6-9-15-23/h6-11,14-17,19-21H,12-13,18H2,1-5H3/b22-19+
InChIKey OJXHEFVAYYGAPE-ZBJSNUHESA-N
Molecular Weight 438.630 g/mol
SMILES C(\C(=C\Sc1ccccc1)CCCC(N(c1ccccc1)C)=O)(N(C(C)C)C(C)C)=O
SPLASH splash10-002f-8973100000-92c9c9fd6a4f41fd0866
Source of Spectrum J-52-224-33
Wiley ID 1384231