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Bicyclo[3.2.0]heptan-6-one, 2-acetyl-3,3-dimethyl-7-(1-methylethyl)-
SpectraBase Compound ID 2i9iu3HnqOH
InChI InChI=1S/C14H22O2/c1-7(2)10-11-9(13(10)16)6-14(4,5)12(11)8(3)15/h7,9-12H,6H2,1-5H3
InChIKey CLIRCIFOQVNSEC-UHFFFAOYSA-N
Mol Weight 222.33 g/mol
Molecular Formula C14H22O2
Exact Mass 222.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DStXGGHGoZy
Name Bicyclo[3.2.0]heptan-6-one, 2-acetyl-3,3-dimethyl-7-(1-methylethyl)-
Alternate Name(s) 2-Acetyl-7-isopropyl-3,3-dimethylbicyclo[3.2.0]heptan-6-one 4-acetyl-3,3-dimethyl-6-propan-2-yl-7-bicyclo[3.2.0]heptanone 4-acetyl-3,3-dimethyl-6-propan-2-ylbicyclo[3.2.0]heptan-7-one 4-acetyl-6-isopropyl-3,3-dimethyl-bicyclo[3.2.0]heptan-7-one 4-ethanoyl-3,3-dimethyl-6-propan-2-yl-bicyclo[3.2.0]heptan-7-one
CAS Registry Number 81052-68-8
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H22O2
InChI InChI=1S/C14H22O2/c1-7(2)10-11-9(13(10)16)6-14(4,5)12(11)8(3)15/h7,9-12H,6H2,1-5H3
InChIKey CLIRCIFOQVNSEC-UHFFFAOYSA-N
Molecular Weight 222.328 g/mol
SMILES C(=O)(C1C(CC2C1C(C2=O)C(C)C)(C)C)C
SPLASH splash10-0udi-0910000000-6155f141614ee33a0306
Source of Spectrum F-37-3342-0
Wiley ID 1222842