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Cyclohexanone-4-(2-adamantyl)thiosemicarbazone
SpectraBase Compound ID 4Xw14xfku10
InChI InChI=1S/C17H27N3S/c21-17(20-19-15-4-2-1-3-5-15)18-16-13-7-11-6-12(9-13)10-14(16)8-11/h11-14,16H,1-10H2,(H2,18,20,21)/t11-,12+,13-,14+,16?
InChIKey OZIILFNOMKHBGG-NEFDOFBUSA-N
Mol Weight 305.48 g/mol
Molecular Formula C17H27N3S
Exact Mass 305.192569 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID TNy0bcInSK
Name Cyclohexanone-4-(2-adamantyl)thiosemicarbazone
Alternate Name(s) N-((1r,3r,5r,7r)-adamantan-2-yl)-2-cyclohexylidenehydrazine-1-carbothioamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H27N3S
InChI InChI=1S/C17H27N3S/c21-17(20-19-15-4-2-1-3-5-15)18-16-13-7-11-6-12(9-13)10-14(16)8-11/h11-14,16H,1-10H2,(H2,18,20,21)/t11-,12+,13-,14+,16?
InChIKey OZIILFNOMKHBGG-NEFDOFBUSA-N
Literature Reference DOI 10.1002/ardp.19843170907
Molecular Weight 305.484 g/mol
SMILES N(C1[C@]2(C[C@@]3(C[C@](C2)(C[C@]1(C3)[H])[H])[H])[H])C(NN=C1CCCCC1)=S
SPLASH splash10-0udi-2901000000-509e08cf1b99c7c3fe42
Source of Spectrum APC-317-770-3d
Wiley ID 1788196