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Bicyclo[5.1.0]octan-2-one, 8-acetyl-3,3,7-trimethyl-
SpectraBase Compound ID 1P5MfoB88V2
InChI InChI=1S/C13H20O2/c1-8(14)9-10-11(15)12(2,3)6-5-7-13(9,10)4/h9-10H,5-7H2,1-4H3
InChIKey XMCYUKMISRCQRU-UHFFFAOYSA-N
Mol Weight 208.3 g/mol
Molecular Formula C13H20O2
Exact Mass 208.14633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2RZF1rnL2kx
Name Bicyclo[5.1.0]octan-2-one, 8-acetyl-3,3,7-trimethyl-
CAS Registry Number 107690-54-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H20O2
InChI InChI=1S/C13H20O2/c1-8(14)9-10-11(15)12(2,3)6-5-7-13(9,10)4/h9-10H,5-7H2,1-4H3
InChIKey XMCYUKMISRCQRU-UHFFFAOYSA-N
Molecular Weight 208.301 g/mol
SMILES C12(C(C(C(C)(C)CCC2)=O)C1C(=O)C)C
SPLASH splash10-00kf-9300000000-ced3019b4dcf42fc89f0
Source of Spectrum H-69-558-12
Synonyms 8-Acetyl-3,3,7-trimethylbicyclo[5.1.0]octan-2-one
Wiley ID 1207231