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5,6,7,8,9,10-Hexahydro-7-[(5'-chloro-8'-hydroxyquinolin-7'-yl)methyl]-2H-naphtho[2,3-b]-(1,4-dioxa-7,10,13-triaza)cyclopentadecine-3,11(4H,12H)-dione

View entire compound with spectra: 1 MS (GC)

5,6,7,8,9,10-Hexahydro-7-[(5'-chloro-8'-hydroxyquinolin-7'-yl)methyl]-2H-naphtho[2,3-b]-(1,4-dioxa-7,10,13-triaza)cyclopentadecine-3,11(4H,12H)-dione
SpectraBase Compound ID 3IuMyhIoltn
InChI InChI=1S/C28H27ClN4O5/c29-22-12-20(28(36)27-21(22)6-3-7-32-27)15-33-10-8-30-25(34)16-37-23-13-18-4-1-2-5-19(18)14-24(23)38-17-26(35)31-9-11-33/h1-7,12-14,36H,8-11,15-17H2,(H,30,34)(H,31,35)
InChIKey CNKGMQBBTSHQLP-UHFFFAOYSA-N
Mol Weight 535.0 g/mol
Molecular Formula C28H27ClN4O5
Exact Mass 534.166998 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DHJ3H31N96C
Name 5,6,7,8,9,10-Hexahydro-7-[(5'-chloro-8'-hydroxyquinolin-7'-yl)methyl]-2H-naphtho[2,3-b]-(1,4-dioxa-7,10,13-triaza)cyclopentadecine-3,11(4H,12H)-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H27ClN4O5
InChI InChI=1S/C28H27ClN4O5/c29-22-12-20(28(36)27-21(22)6-3-7-32-27)15-33-10-8-30-25(34)16-37-23-13-18-4-1-2-5-19(18)14-24(23)38-17-26(35)31-9-11-33/h1-7,12-14,36H,8-11,15-17H2,(H,30,34)(H,31,35)
InChIKey CNKGMQBBTSHQLP-UHFFFAOYSA-N
Molecular Weight 535.000 g/mol
SMILES Oc1c(CN2CCNC(=O)COc3cc4ccccc4cc3OCC(NCC2)=O)cc(c2cccnc12)Cl
SPLASH splash10-0kdi-7390000000-152dc877d562dc04c5a7
Source of Spectrum H-91-1370-14
Wiley ID 1693424