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Methyl 5-adamantyl-2-(methylsulfanyl)penta-2,4-dienoate
SpectraBase Compound ID 16DP5lin2J5
InChI InChI=1S/C17H24O2S/c1-19-16(18)15(20-2)4-3-5-17-9-12-6-13(10-17)8-14(7-12)11-17/h3-5,12-14H,6-11H2,1-2H3/b5-3+,15-4-/t12-,13+,14-,17+
InChIKey IXQUHDOVYHUSCG-CJKYXJGOSA-N
Mol Weight 292.44 g/mol
Molecular Formula C17H24O2S
Exact Mass 292.149701 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2vlmXZDEs3C
Name Methyl 5-adamantyl-2-(methylsulfanyl)penta-2,4-dienoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H24O2S
InChI InChI=1S/C17H24O2S/c1-19-16(18)15(20-2)4-3-5-17-9-12-6-13(10-17)8-14(7-12)11-17/h3-5,12-14H,6-11H2,1-2H3/b5-3+,15-4-/t12-,13+,14-,17+
InChIKey IXQUHDOVYHUSCG-CJKYXJGOSA-N
Molecular Weight 292.437 g/mol
SMILES C12(\C=C\C=C\(C(=O)OC)SC)C[C@]3(C[C@@](C2)(C[C@@](C1)(C3)[H])[H])[H]
SPLASH splash10-052f-9560000000-47aa38bc39c0bfdd4270
Source of Spectrum F9-1988-641-0
Synonyms Methyl (2Z,4E)-5-(1-adamantyl)-2-(methylsulfanyl)-2,4-pentadienoate
Wiley ID 1565898