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2-Buten-1-one, 1-(3,3-dimethylbicyclo[2.2.1]hept-2-yl)-3-methyl-, exo-
SpectraBase Compound ID KR2SYEu8fvW
InChI InChI=1S/C14H22O/c1-9(2)7-12(15)13-10-5-6-11(8-10)14(13,3)4/h7,10-11,13H,5-6,8H2,1-4H3
InChIKey UXOGKCYMGMRHNW-UHFFFAOYSA-N
Mol Weight 206.33 g/mol
Molecular Formula C14H22O
Exact Mass 206.167065 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Fl6hpnggpW
Name 2-Buten-1-one, 1-(3,3-dimethylbicyclo[2.2.1]hept-2-yl)-3-methyl-, exo-
CAS Registry Number 113104-67-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H22O
InChI InChI=1S/C14H22O/c1-9(2)7-12(15)13-10-5-6-11(8-10)14(13,3)4/h7,10-11,13H,5-6,8H2,1-4H3
InChIKey UXOGKCYMGMRHNW-UHFFFAOYSA-N
Molecular Weight 206.329 g/mol
SMILES C(C1C(C2CC1CC2)(C)C)(C=C(C)C)=O
SPLASH splash10-05u6-9510000000-6557204047880e1ff79d
Source of Spectrum AH-118-396-21
Synonyms 1-(3,3-Dimethyl-2-exo-norbornyl)-3-methylbut-2-en-1-on 1-(3,3-dimethylbicyclo[2.2.1]hept-2-yl)-3-methyl-2-buten-1-one
Wiley ID 1205237