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1,5,2,4-Ethanediylidene-3H-cyclopent[cd]inden-3-one, 1,2,2a,4,4a,5,7a,7b-octahydro-
SpectraBase Compound ID HYccbi6hVmF
InChI InChI=1S/C13H12O/c14-13-11-7-3-1-2-4-6-5(3)9(11)10(6)12(13)8(4)7/h1-12H/t3-,4+,5-,6+,7+,8-,9-,10-,11-,12+/m0/s1
InChIKey AOERPTZMWBRKPC-QQLIJTTKSA-N
Mol Weight 184.24 g/mol
Molecular Formula C13H12O
Exact Mass 184.088815 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4sXt9Z9nuSO
Name 1,5,2,4-Ethanediylidene-3H-cyclopent[cd]inden-3-one, 1,2,2a,4,4a,5,7a,7b-octahydro-
CAS Registry Number 116596-51-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H12O
InChI InChI=1S/C13H12O/c14-13-11-7-3-1-2-4-6-5(3)9(11)10(6)12(13)8(4)7/h1-12H/t3-,4+,5-,6+,7+,8-,9-,10-,11-,12+/m0/s1
InChIKey AOERPTZMWBRKPC-QQLIJTTKSA-N
Molecular Weight 184.238 g/mol
SMILES [C@@]12(C([C@]3([C@@]4([C@@]2([C@@]2([C@]4([C@@]4([C@]3([C@]1([C@]2(C=C4)[H])[H])[H])[H])[H])[H])[H])[H])[H])=O)[H]
SPLASH splash10-003r-4900000000-46cf387bea652b31099e
Source of Spectrum J-53-5170-7
Synonyms Hexacyclo[5.5.1.0(2,6).0(3,10).0(4,8).0(9,13)]tridec-11-en-5-one
Wiley ID 1181412