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Cyclopentanone, 3,3-dimethyl-2-(3-methyl-1,3-butadienyl)-, (E)-
SpectraBase Compound ID F6PaIKwAgxd
InChI InChI=1S/C12H18O/c1-9(2)5-6-10-11(13)7-8-12(10,3)4/h5-6,10H,1,7-8H2,2-4H3/b6-5+
InChIKey IPMKEKGQJXHVJI-AATRIKPKSA-N
Mol Weight 178.27 g/mol
Molecular Formula C12H18O
Exact Mass 178.135765 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6LnoZY584T5
Name Cyclopentanone, 3,3-dimethyl-2-(3-methyl-1,3-butadienyl)-, (E)-
Alternate Name(s) 3,3-Dimethyl-2-[(1E)-3-methyl-1,3-butadienyl]cyclopentanone 3,3-Dimethyl-2-[(1E)-3-methylbuta-1,3-dienyl]-1-cyclopentanone 3,3-Dimethyl-2-[(1E)-3-methylbuta-1,3-dienyl]cyclopentan-1-one 3,3-Dimethyl-2-[(1E)-3-methylbuta-1,3-dienyl]cyclopentanone
CAS Registry Number 88725-86-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18O
InChI InChI=1S/C12H18O/c1-9(2)5-6-10-11(13)7-8-12(10,3)4/h5-6,10H,1,7-8H2,2-4H3/b6-5+
InChIKey IPMKEKGQJXHVJI-AATRIKPKSA-N
Molecular Weight 178.275 g/mol
SMILES C1(=O)C(C(CC1)(C)C)\C=C\C(=C)C
SPLASH splash10-0563-9600000000-45c30389fd489a983232
Wiley ID 1489281