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Pyrovalerone
SpectraBase Compound ID B28u4A5Antz
InChI InChI=1S/C16H23NO/c1-3-6-15(17-11-4-5-12-17)16(18)14-9-7-13(2)8-10-14/h7-10,15H,3-6,11-12H2,1-2H3
InChIKey SWUVZKWCOBGPTH-UHFFFAOYSA-N
Mol Weight 245.37 g/mol
Molecular Formula C16H23NO
Exact Mass 245.177964 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FaQXDpaJLgM
Name Pyrovalerone
Catalog Number 10817
CAS Registry Number 3563-49-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H23NO
InChI InChI=1S/C16H23NO/c1-3-6-15(17-11-4-5-12-17)16(18)14-9-7-13(2)8-10-14/h7-10,15H,3-6,11-12H2,1-2H3
InChIKey SWUVZKWCOBGPTH-UHFFFAOYSA-N
Molecular Weight 245.366 g/mol
SMILES CCCC(C(=O)c1ccc(cc1)C)N1CCCC1
SPLASH splash10-004i-4900000000-af5db61725a7826a1705
Source of Spectrum CAY-2023-2006-0
Wiley ID 1889942