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cis-3a,4,5,6,7,7a-Hexahydro-1H-inden-1-one
SpectraBase Compound ID B4YOvB9EftF
InChI InChI=1S/C9H12O/c10-9-6-5-7-3-1-2-4-8(7)9/h5-8H,1-4H2/t7-,8-/m1/s1
InChIKey PUQNYWRSNUVKMW-HTQZYQBOSA-N
Mol Weight 136.19 g/mol
Molecular Formula C9H12O
Exact Mass 136.088815 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8p7TdWhbhm8
Name cis-3a,4,5,6,7,7a-Hexahydro-1H-inden-1-one
Alternate Name(s) (3aR,7aR)-3a,4,5,6,7,7a-hexahydro-1H-inden-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H12O
InChI InChI=1S/C9H12O/c10-9-6-5-7-3-1-2-4-8(7)9/h5-8H,1-4H2/t7-,8-/m1/s1
InChIKey PUQNYWRSNUVKMW-HTQZYQBOSA-N
Literature Reference DOI 10.1002/hlca.19830660802
Molecular Weight 136.194 g/mol
SMILES C1(C=C[C@]2(CCCC[C@@]12[H])[H])=O
SPLASH splash10-0a70-9600000000-b8cc593208fa0afcec4e
Source of Spectrum H-66-2392-4b
Wiley ID 1794836