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1-Adamantan-1-ylbuta-2,3-dien-1-one
SpectraBase Compound ID BtWV6dbsfvp
InChI InChI=1S/C14H18O/c1-2-3-13(15)14-7-10-4-11(8-14)6-12(5-10)9-14/h3,10-12H,1,4-9H2/t10-,11+,12-,14-
InChIKey HMKRKHROBQAOAW-XDCQQTESSA-N
Mol Weight 202.3 g/mol
Molecular Formula C14H18O
Exact Mass 202.135765 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DkHAMqbhx5d
Name 1-Adamantan-1-ylbuta-2,3-dien-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H18O
InChI InChI=1S/C14H18O/c1-2-3-13(15)14-7-10-4-11(8-14)6-12(5-10)9-14/h3,10-12H,1,4-9H2/t10-,11+,12-,14-
InChIKey HMKRKHROBQAOAW-XDCQQTESSA-N
Literature Reference DOI 10.1002_(SICI)1521-3897(199905)341_4_342
Molecular Weight 202.297 g/mol
SMILES C1[C@]2(CC3(C[C@@]1(C[C@@](C2)(C3)[H])[H])C(=O)C=C=C)[H]
SPLASH splash10-000i-1900000000-2fdd23b8579d0bd7fc75
Source of Spectrum JF-341-348-1b
Synonyms 1-((3r,5r,7r)-adamantan-1-yl)buta-2,3-dien-1-one
Wiley ID 1766680