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4,5,6,7,8,9,10,11,12,13,14,14a-Dodecahydro-14a-hydroxy[1,4]diazacyclohexadecino[16,1-a]Isoindole-2,19(1H,3H)-dione
SpectraBase Compound ID G7w7fOT7nj1
InChI InChI=1S/C21H30N2O3/c24-19-16-23-20(25)17-12-8-9-13-18(17)21(23,26)14-10-6-4-2-1-3-5-7-11-15-22-19/h8-9,12-13,26H,1-7,10-11,14-16H2,(H,22,24)
InChIKey SCTWPVBRZWMLDT-UHFFFAOYSA-N
Mol Weight 358.48 g/mol
Molecular Formula C21H30N2O3
Exact Mass 358.225643 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2VtyvYJdnaO
Name 4,5,6,7,8,9,10,11,12,13,14,14a-Dodecahydro-14a-hydroxy[1,4]diazacyclohexadecino[16,1-a]Isoindole-2,19(1H,3H)-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H30N2O3
InChI InChI=1S/C21H30N2O3/c24-19-16-23-20(25)17-12-8-9-13-18(17)21(23,26)14-10-6-4-2-1-3-5-7-11-15-22-19/h8-9,12-13,26H,1-7,10-11,14-16H2,(H,22,24)
InChIKey SCTWPVBRZWMLDT-UHFFFAOYSA-N
Literature Reference DOI 10.1002/hlca.19970800324
Molecular Weight 358.482 g/mol
SMILES N1CCCCCCCCCCCC2(N(C(c3c2cccc3)=O)CC1=O)O
SPLASH splash10-03di-0900000000-db960082c417939e55a0
Source of Spectrum H-80-932-26a
Synonyms 14a-hydroxy-4,5,6,7,8,9,10,11,12,13,14,14a-dodecahydro-[1,4]diazacyclohexadecino[16,1-a]isoindole-2,19(1H,3H)-dione
Wiley ID 1785283