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1-(3,3-Dichloro-1-propynyl)adamantane
SpectraBase Compound ID 3tqpaQgVgih
InChI InChI=1S/C13H16Cl2/c14-12(15)1-2-13-6-9-3-10(7-13)5-11(4-9)8-13/h9-12H,3-8H2/t9-,10+,11-,13+
InChIKey DIYOHQNCVGANID-UPFUWZEBSA-N
Mol Weight 243.18 g/mol
Molecular Formula C13H16Cl2
Exact Mass 242.062906 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CksmOneBYqj
Name ADAMANTANE-1-(3,3-DICHLOROPROPYN-1-YL)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C13H16Cl2
InChI InChI=1S/C13H16Cl2/c14-12(15)1-2-13-6-9-3-10(7-13)5-11(4-9)8-13/h9-12H,3-8H2/t9-,10+,11-,13+
InChIKey DIYOHQNCVGANID-UPFUWZEBSA-N
Molecular Weight 242.0626
SMILES [C@]12(C[C@@]3(C[C@@](CC(C#CC(Cl)Cl)(C3)C1)(C2)[H])[H])[H]
SPLASH splash10-0a6u-9720000000-debe26f2b4e2ae9152cf
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany