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4-Adamantan-1-yl-piperazine-1-carbothioic acid phenethyl-amide
SpectraBase Compound ID EZB71xzc2Xe
InChI InChI=1S/C23H33N3S/c27-22(24-7-6-18-4-2-1-3-5-18)25-8-10-26(11-9-25)23-15-19-12-20(16-23)14-21(13-19)17-23/h1-5,19-21H,6-17H2,(H,24,27)/t19-,20+,21-,23-
InChIKey FJDNIGBGUJFUDB-HOFYVFDJSA-N
Mol Weight 383.6 g/mol
Molecular Formula C23H33N3S
Exact Mass 383.239519 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B15kErShPxA
Name 4-Adamantan-1-yl-piperazine-1-carbothioic acid phenethyl-amide
Alternate Name(s) 4-(1-Adamantyl)-N-(2-phenylethyl)-1-piperazinecarbothioamide 4-(1-adamantyl)-N-phenethyl-piperazine-1-carbothioamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H33N3S
InChI InChI=1S/C23H33N3S/c27-22(24-7-6-18-4-2-1-3-5-18)25-8-10-26(11-9-25)23-15-19-12-20(16-23)14-21(13-19)17-23/h1-5,19-21H,6-17H2,(H,24,27)/t19-,20+,21-,23-
InChIKey FJDNIGBGUJFUDB-HOFYVFDJSA-N
Molecular Weight 383.598 g/mol
SMILES N(C(N1CCN(C23C[C@]4(C[C@@](C3)(C[C@@](C2)(C4)[H])[H])[H])CC1)=S)CCc1ccccc1
SPLASH splash10-004u-3900000000-ceab29f6ccc26efa5b51
Wiley ID 1463680