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5H-Cyclohept[c]isoquinolin-5-one, 6-butyl-6,7,8,9,10,11-hexahydro-
SpectraBase Compound ID Loshwr68uog
InChI InChI=1S/C18H23NO/c1-2-3-13-19-17-12-6-4-5-10-15(17)14-9-7-8-11-16(14)18(19)20/h7-9,11H,2-6,10,12-13H2,1H3
InChIKey CTDHEPIGACGEBU-UHFFFAOYSA-N
Mol Weight 269.39 g/mol
Molecular Formula C18H23NO
Exact Mass 269.177964 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CVv67RtC29E
Name 5H-Cyclohept[c]isoquinolin-5-one, 6-butyl-6,7,8,9,10,11-hexahydro-
Alternate Name(s) 6-Butyl-6,7,8,9,10,11-hexahydro-5H-cyclohepta[c]isoquinolin-5-one 6-n-butyl-8,9,10,11-tetrahydro-7H-cyclohepta[c]isoquinolin-5(6H)-one
CAS Registry Number 120637-36-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H23NO
InChI InChI=1S/C18H23NO/c1-2-3-13-19-17-12-6-4-5-10-15(17)14-9-7-8-11-16(14)18(19)20/h7-9,11H,2-6,10,12-13H2,1H3
InChIKey CTDHEPIGACGEBU-UHFFFAOYSA-N
Molecular Weight 269.388 g/mol
SMILES C1(N(C2=C(c3ccccc13)CCCCC2)CCCC)=O
SPLASH splash10-0j4i-0190000000-0a9e7af9e6518d1b96a3
Source of Spectrum J-54-2996-23
Wiley ID 1273452