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(3E)-4-(2,2,6,7-Tetramethyl-7-azabicyclo[4.1.0]hept-1-yl)-3-buten-2-one
SpectraBase Compound ID JELdsL8dx60
InChI InChI=1S/C14H23NO/c1-11(16)7-10-14-12(2,3)8-6-9-13(14,4)15(14)5/h7,10H,6,8-9H2,1-5H3/b10-7+
InChIKey RHMVVEZIENACES-JXMROGBWSA-N
Mol Weight 221.34 g/mol
Molecular Formula C14H23NO
Exact Mass 221.177964 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7x8qduubfT1
Name (3E)-4-(2,2,6,7-Tetramethyl-7-azabicyclo[4.1.0]hept-1-yl)-3-buten-2-one
CAS Registry Number 102635-60-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H23NO
InChI InChI=1S/C14H23NO/c1-11(16)7-10-14-12(2,3)8-6-9-13(14,4)15(14)5/h7,10H,6,8-9H2,1-5H3/b10-7+
InChIKey RHMVVEZIENACES-JXMROGBWSA-N
Molecular Weight 221.344 g/mol
SMILES C12(C(C(CCC2)(C)C)(N1C)\C=C\C(=O)C)C
SPLASH splash10-05bf-9800000000-cc067a94adf1d7b8a684
Source of Spectrum H-68-1111-2
Synonyms (E)-4-(1,5,5,7-tetramethyl-7-azabicyclo[4.1.0]heptan-6-yl)-3-buten-2-one (E)-4-(1,5,5,7-tetramethyl-7-azabicyclo[4.1.0]heptan-6-yl)but-3-en-2-one 3-Buten-2-one, 4-(2,2,6,7-tetramethyl-7-azabicyclo[4.1.0]heptan-1-yl)-
Wiley ID 1221499