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3a-Methyl-7-oxooctahydroindene-1-carbonitrile
SpectraBase Compound ID BWHGbxi8AQh
InChI InChI=1S/C11H15NO/c1-11-5-2-3-9(13)10(11)8(7-12)4-6-11/h8,10H,2-6H2,1H3
InChIKey OCSCZNXPSXYTDG-UHFFFAOYSA-N
Mol Weight 177.25 g/mol
Molecular Formula C11H15NO
Exact Mass 177.115364 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JoK73HCYukw
Name 3a-Methyl-7-oxooctahydroindene-1-carbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H15NO
InChI InChI=1S/C11H15NO/c1-11-5-2-3-9(13)10(11)8(7-12)4-6-11/h8,10H,2-6H2,1H3
InChIKey OCSCZNXPSXYTDG-UHFFFAOYSA-N
Molecular Weight 177.247 g/mol
SMILES C12(C(C(=O)CCC2)C(C#N)CC1)C
SPLASH splash10-0a59-6900000000-ffede9472b8d1ebf7956
Source of Spectrum U-1995-235-6
Synonyms 3a-methyl-7-oxooctahydro-1H-indene-1-carbonitrile
Wiley ID 766509