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2-Cyclohexen-1-one, 3-[[2-(1,3-benzodioxol-5-yl)-2-ethoxyethyl]amino]-
SpectraBase Compound ID HpPXna0sQnr
InChI InChI=1S/C17H21NO4/c1-2-20-17(10-18-13-4-3-5-14(19)9-13)12-6-7-15-16(8-12)22-11-21-15/h6-9,17-18H,2-5,10-11H2,1H3
InChIKey XPFXTGNYNQABLQ-UHFFFAOYSA-N
Mol Weight 303.36 g/mol
Molecular Formula C17H21NO4
Exact Mass 303.147058 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FHLX42M411W
Name 2-Cyclohexen-1-one, 3-[[2-(1,3-benzodioxol-5-yl)-2-ethoxyethyl]amino]-
Alternate Name(s) 3-[[2-(1,3-benzodioxol-5-yl)-2-ethoxyethyl]amino]-1-cyclohex-2-enone 3-[[2-(1,3-benzodioxol-5-yl)-2-ethoxyethyl]amino]cyclohex-2-en-1-one
CAS Registry Number 62681-63-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H21NO4
InChI InChI=1S/C17H21NO4/c1-2-20-17(10-18-13-4-3-5-14(19)9-13)12-6-7-15-16(8-12)22-11-21-15/h6-9,17-18H,2-5,10-11H2,1H3
InChIKey XPFXTGNYNQABLQ-UHFFFAOYSA-N
Molecular Weight 303.358 g/mol
SMILES N(C1=CC(=O)CCC1)CC(c1cc2OCOc2cc1)OCC
SPLASH splash10-0giu-5693000000-93f2b89da711d1a12b2c
Source of Spectrum KC-1976-2487-0
Wiley ID 1305638