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2-Penten-1-one, 1-(3,3-dimethylbicyclo[2.2.1]hept-2-yl)-, endo-
SpectraBase Compound ID JAJsYM23Jkk
InChI InChI=1S/C14H22O/c1-4-5-6-12(15)13-10-7-8-11(9-10)14(13,2)3/h5-6,10-11,13H,4,7-9H2,1-3H3/b6-5+/t10-,11-,13-/m0/s1
InChIKey ZIJNHCKFBZOJGW-KIHZXTENSA-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 6SGnXemc1is
Name 2-Penten-1-one, 1-(3,3-dimethylbicyclo[2.2.1]hept-2-yl)-, endo-
CAS Registry Number 101469-32-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H22O
InChI InChI=1S/C14H22O/c1-4-5-6-12(15)13-10-7-8-11(9-10)14(13,2)3/h5-6,10-11,13H,4,7-9H2,1-3H3/b6-5+/t10-,11-,13-/m0/s1
InChIKey ZIJNHCKFBZOJGW-KIHZXTENSA-N
Molecular Weight 206.329 g/mol
SMILES C1([C@@]([C@@]2(C[C@@]1(CC2)[H])[H])(C(\C=C\CC)=O)[H])(C)C
SPLASH splash10-001i-9100000000-5ac4816439ae7bbbc055
Source of Spectrum AH-116-811-15
Synonyms (2E)-1-(3,3-dimethylbicyclo[2.2.1]hept-2-yl)-2-penten-1-one 1-(3,3-Dimethyl-bicyclo[2.2.1.]hept-2-yl)-2-penten-1-one
Wiley ID 1205154