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Azacycloheptadecane-2,13-dione, 1-[3-[[4-(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)butyl]amino]propyl]-
SpectraBase Compound ID 7nkH4ZZvxmY
InChI InChI=1S/C31H47N3O4/c35-26-16-7-5-3-1-2-4-6-8-20-29(36)33(23-13-11-17-26)24-15-22-32-21-12-14-25-34-30(37)27-18-9-10-19-28(27)31(34)38/h9-10,18-19,32H,1-8,11-17,20-25H2
InChIKey LUMDLSSIJJUCEI-UHFFFAOYSA-N
Mol Weight 525.7 g/mol
Molecular Formula C31H47N3O4
Exact Mass 525.356657 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I5pU66HMoy3
Name Azacycloheptadecane-2,13-dione, 1-[3-[[4-(1,3-dihydro-1,3-dioxo-2H-isoindol-2-yl)butyl]amino]propyl]-
CAS Registry Number 122890-27-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H47N3O4
InChI InChI=1S/C31H47N3O4/c35-26-16-7-5-3-1-2-4-6-8-20-29(36)33(23-13-11-17-26)24-15-22-32-21-12-14-25-34-30(37)27-18-9-10-19-28(27)31(34)38/h9-10,18-19,32H,1-8,11-17,20-25H2
InChIKey LUMDLSSIJJUCEI-UHFFFAOYSA-N
Molecular Weight 525.734 g/mol
SMILES N(CCCCN1C(c2ccccc2C1=O)=O)CCCN1C(=O)CCCCCCCCCCC(=O)CCCC1
SPLASH splash10-01q0-9356010000-f9cc5fc55d1b0028f219
Source of Spectrum H-71-1717-28
Synonyms 12-oxo-N-(8-phthalimido-4-azaoctyl)-16-hexadecane-lactam 2-(4-{[3-(2,13-dioxoazacycloheptadecan-1-yl)propyl]amino}butyl)-1H-isoindole-1,3(2H)-dione
Wiley ID 1402693