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5-Acetyl-3-ethyl-6-phenyl-1,2,3,6-tetrahydropyrrolo[1,2-d][1,4]diazocine-8-carbaldehyde
SpectraBase Compound ID E5HBHr970NJ
InChI InChI=1S/C20H22N2O2/c1-3-21-9-10-22-12-16(14-23)11-19(22)20(18(13-21)15(2)24)17-7-5-4-6-8-17/h4-8,11-14,20H,3,9-10H2,1-2H3/b18-13-
InChIKey NTFRORMOVKGWGJ-AQTBWJFISA-N
Mol Weight 322.41 g/mol
Molecular Formula C20H22N2O2
Exact Mass 322.168128 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5GO5ZxzGsXJ
Name 5-Acetyl-3-ethyl-6-phenyl-1,2,3,6-tetrahydropyrrolo[1,2-d][1,4]diazocine-8-carbaldehyde
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H22N2O2
InChI InChI=1S/C20H22N2O2/c1-3-21-9-10-22-12-16(14-23)11-19(22)20(18(13-21)15(2)24)17-7-5-4-6-8-17/h4-8,11-14,20H,3,9-10H2,1-2H3/b18-13-
InChIKey NTFRORMOVKGWGJ-AQTBWJFISA-N
Molecular Weight 322.408 g/mol
SMILES c12[n](cc(c2)C=O)CCN(\C=C/(C1c1ccccc1)C(=O)C)CC
SPLASH splash10-0006-9033000000-415c45123e8b5ec6b9c2
Source of Spectrum F-66-5146-26
Wiley ID 1683392