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4-Isopropylbicyclo(3.2.2)nona-3,6-dien-2-one
SpectraBase Compound ID 2lHQYGRLK8M
InChI InChI=1S/C12H16O/c1-8(2)11-7-12(13)10-5-3-9(11)4-6-10/h3,5,7-10H,4,6H2,1-2H3/t9-,10-/m1/s1
InChIKey WNDHRWVXEFLALM-NXEZZACHSA-N
Mol Weight 176.26 g/mol
Molecular Formula C12H16O
Exact Mass 176.120115 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4hTqOUTMtmG
Name 4-Isopropylbicyclo(3.2.2)nona-3,6-dien-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16O
InChI InChI=1S/C12H16O/c1-8(2)11-7-12(13)10-5-3-9(11)4-6-10/h3,5,7-10H,4,6H2,1-2H3/t9-,10-/m1/s1
InChIKey WNDHRWVXEFLALM-NXEZZACHSA-N
Ionization Type EI-B
Molecular Weight 176.259 g/mol
SMILES CC(C)C1=CC([C@@]2(C=C[C@@]1(CC2)[H])[H])=O
SPLASH splash10-001i-0900000000-69e4888282ab261966f3
Source of Spectrum SRH-2022-4630-0
Wiley ID 1826762