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1-Methyl-3a,4,5,6-tetrahydro-2(3H)-pentalenone
SpectraBase Compound ID LWBN9GVNmkr
InChI InChI=1S/C9H12O/c1-6-8-4-2-3-7(8)5-9(6)10/h7H,2-5H2,1H3
InChIKey JGJPPHHPGVPFFQ-UHFFFAOYSA-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 3nmzosGw8Qj
Name 1-Methyl-3a,4,5,6-tetrahydro-2(3H)-pentalenone
CAS Registry Number 127183-22-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H12O
InChI InChI=1S/C9H12O/c1-6-8-4-2-3-7(8)5-9(6)10/h7H,2-5H2,1H3
InChIKey JGJPPHHPGVPFFQ-UHFFFAOYSA-N
Molecular Weight 136.194 g/mol
SMILES C12=C(C(CC2CCC1)=O)C
SPLASH splash10-0553-9800000000-422de136770528e9c876
Source of Spectrum U-1992-674-14
Synonyms 3-Methyl-4,5,6,6a-tetrahydro-1H-pentalen-2-one
Wiley ID 764340