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1-piperazinecarbothioamide, N-(2-phenylethyl)-4-tricyclo[3.3.1.1~3,7~]dec-1-yl-

View entire compound with spectra: 2 NMR, and 1 FTIR

1-piperazinecarbothioamide, N-(2-phenylethyl)-4-tricyclo[3.3.1.1~3,7~]dec-1-yl-
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

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DjxOs40QU8G
Name 4-Adamantan-1-yl-piperazine-1-carbothioic acid phenethyl-amide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 383.239519249 u
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 C12(N3CCN(C(=S)NCCC4=CC=CC=C4)CC3)C[C@]3(C[C@@](C1)(C[C@@](C2)(C3)[H])[H])[H]