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5-Acetyl-3-ethyl-6-(2-thienyl)-1,2,3,6-tetrahydropyrrolo[1,2-d][1,4]diazocine-9-carbaldehyde
SpectraBase Compound ID FXh5h6y6yIf
InChI InChI=1S/C18H20N2O2S/c1-3-19-8-9-20-14(12-21)6-7-16(20)18(15(11-19)13(2)22)17-5-4-10-23-17/h4-7,10-12,18H,3,8-9H2,1-2H3/b15-11-
InChIKey IMURJSRTOFJDBG-PTNGSMBKSA-N
Mol Weight 328.43 g/mol
Molecular Formula C18H20N2O2S
Exact Mass 328.124549 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BBy7606lTY5
Name 5-Acetyl-3-ethyl-6-(2-thienyl)-1,2,3,6-tetrahydropyrrolo[1,2-d][1,4]diazocine-9-carbaldehyde
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H20N2O2S
InChI InChI=1S/C18H20N2O2S/c1-3-19-8-9-20-14(12-21)6-7-16(20)18(15(11-19)13(2)22)17-5-4-10-23-17/h4-7,10-12,18H,3,8-9H2,1-2H3/b15-11-
InChIKey IMURJSRTOFJDBG-PTNGSMBKSA-N
Molecular Weight 328.430 g/mol
SMILES c12[n](c(C=O)cc2)CCN(\C=C/(C1c1sccc1)C(=O)C)CC
SPLASH splash10-004i-2109000000-8265897ce1dfa9cd3a2c
Source of Spectrum F-66-5148-38
Wiley ID 1683386