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N-ethyl Heptylone
SpectraBase Compound ID Hp3CH3KaGQ8
InChI InChI=1S/C16H23NO3/c1-3-5-6-7-13(17-4-2)16(18)12-8-9-14-15(10-12)20-11-19-14/h8-10,13,17H,3-7,11H2,1-2H3
InChIKey ZYFSMTZZSZKLKU-UHFFFAOYSA-N
Mol Weight 277.36 g/mol
Molecular Formula C16H23NO3
Exact Mass 277.167794 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FL6CwdJwO5U
Name N-ethyl Heptylone
Catalog Number 26923
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H23NO3
InChI InChI=1S/C16H23NO3/c1-3-5-6-7-13(17-4-2)16(18)12-8-9-14-15(10-12)20-11-19-14/h8-10,13,17H,3-7,11H2,1-2H3
InChIKey ZYFSMTZZSZKLKU-UHFFFAOYSA-N
Molecular Weight 277.364 g/mol
SMILES N(C(C(=O)c1cc2OCOc2cc1)CCCCC)CC
SPLASH splash10-004i-3900000000-9a4969d3e64bf4d105d8
Source of Spectrum CAY-2023-280-0
Wiley ID 1888246