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Adamantyl methyl phenylcarbonimidodithioate
SpectraBase Compound ID E3ypgZCeDVW
InChI InChI=1S/C18H23NS2/c1-20-17(19-16-5-3-2-4-6-16)21-18-10-13-7-14(11-18)9-15(8-13)12-18/h2-6,13-15H,7-12H2,1H3/b19-17+/t13-,14+,15-,18-
InChIKey FRCYXZSIDZYWHJ-ZCVWTMJQSA-N
Mol Weight 317.51 g/mol
Molecular Formula C18H23NS2
Exact Mass 317.127192 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3ajpexJnKOz
Name Adamantyl methyl phenylcarbonimidodithioate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H23NS2
InChI InChI=1S/C18H23NS2/c1-20-17(19-16-5-3-2-4-6-16)21-18-10-13-7-14(11-18)9-15(8-13)12-18/h2-6,13-15H,7-12H2,1H3/b19-17+/t13-,14+,15-,18-
InChIKey FRCYXZSIDZYWHJ-ZCVWTMJQSA-N
Literature Reference DOI 10.1021/ol702832x
Molecular Weight 317.509 g/mol
SMILES C12(C[C@]3(C[C@](C[C@@](C2)(C3)[H])(C1)[H])[H])S\C(SC)=N\c1ccccc1
SPLASH splash10-0ufu-9511000000-d9cb9a441ba7f73c52b0
Source of Spectrum A1-10-985/SM5-12
Synonyms (E)-(3s,5s,7s)-adamantan-1-yl methyl phenylcarbonimidodithioate
Wiley ID 1759020