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5-Acetyl-3-methyl-6-(4-methylphenyl)-1,2,3,6-tetrahy-dropyrrolo[1,2-d][1,4]diazocine-9-carbaldehyde
SpectraBase Compound ID 1rq2oCWryvD
InChI InChI=1S/C20H22N2O2/c1-14-4-6-16(7-5-14)20-18(15(2)24)12-21(3)10-11-22-17(13-23)8-9-19(20)22/h4-9,12-13,20H,10-11H2,1-3H3/b18-12-
InChIKey WDQAKGCVCZJKIW-PDGQHHTCSA-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 70NsquDAnsU
Name 5-Acetyl-3-methyl-6-(4-methylphenyl)-1,2,3,6-tetrahy-dropyrrolo[1,2-d][1,4]diazocine-9-carbaldehyde
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H22N2O2
InChI InChI=1S/C20H22N2O2/c1-14-4-6-16(7-5-14)20-18(15(2)24)12-21(3)10-11-22-17(13-23)8-9-19(20)22/h4-9,12-13,20H,10-11H2,1-3H3/b18-12-
InChIKey WDQAKGCVCZJKIW-PDGQHHTCSA-N
Molecular Weight 322.408 g/mol
SMILES c12[n](c(C=O)cc2)CCN(\C=C/(C1c1ccc(cc1)C)C(=O)C)C
SPLASH splash10-00dl-5159000000-6ae596995056ea7149d5
Source of Spectrum F-66-5146-27
Wiley ID 1683391