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4-Chloro-1-acetyladamantane
SpectraBase Compound ID 4if0PAt9KED
InChI InChI=1S/C12H17ClO/c1-7(14)12-4-8-2-9(5-12)11(13)10(3-8)6-12/h8-11H,2-6H2,1H3/t8?,9-,10+,11+,12-
InChIKey VFTYKUUJMMFIDX-YIHPLGNESA-N
Mol Weight 212.72 g/mol
Molecular Formula C12H17ClO
Exact Mass 212.096793 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5dq0I7vNcZz
Name 4-Chloro-1-acetyladamantane
CAS Registry Number 116002-41-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H17ClO
InChI InChI=1S/C12H17ClO/c1-7(14)12-4-8-2-9(5-12)11(13)10(3-8)6-12/h8-11H,2-6H2,1H3/t8?,9-,10+,11+,12-
InChIKey VFTYKUUJMMFIDX-YIHPLGNESA-N
Molecular Weight 212.720 g/mol
SMILES [C@]12(C[C@@]3(CC(C2)C[C@](C1)([C@@]3(Cl)[H])[H])[H])C(=O)C
SPLASH splash10-0159-0900000000-c52fa68512a728e63b61
Source of Spectrum J-53-4373-16
Synonyms 1-(4-Chloro-1-adamantyl)ethanone
Wiley ID 1211423