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N(S)-.alpha.-Methylbenzylthiocinnamamide
SpectraBase Compound ID I8x5pV3MyvZ
InChI InChI=1S/C17H17NS/c1-14(16-10-6-3-7-11-16)18-17(19)13-12-15-8-4-2-5-9-15/h2-14H,1H3,(H,18,19)/b13-12+/t14-/m0/s1
InChIKey JQRUQUABTOEXKT-FNDVETGQSA-N
Mol Weight 267.39 g/mol
Molecular Formula C17H17NS
Exact Mass 267.108171 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6xmCgI2O7UR
Name N(S)-.alpha.-Methylbenzylthiocinnamamide
Alternate Name(s) (2E)-3-phenyl-N-[(1S)-1-phenylethyl]-2-propenethioamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H17NS
InChI InChI=1S/C17H17NS/c1-14(16-10-6-3-7-11-16)18-17(19)13-12-15-8-4-2-5-9-15/h2-14H,1H3,(H,18,19)/b13-12+/t14-/m0/s1
InChIKey JQRUQUABTOEXKT-FNDVETGQSA-N
Molecular Weight 267.390 g/mol
SMILES N(C(\C=C\c1ccccc1)=S)[C@](c1ccccc1)(C)[H]
SPLASH splash10-0avi-2910000000-9e58c7ae5eb716964f70
Source of Spectrum F-54-3228-11
Wiley ID 806309