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Acetamide, N-[3-(acetylamino)propyl]-N-[4-[15-methoxy-2-[(4-methoxyphenyl)methyl]-3,9-dioxo-4,8-diazabicyclo[10.3.1]hexadeca-1(16),12,14-trien-4-yl]b utyl]-, (S)-
SpectraBase Compound ID BJoGA2ICJfJ
InChI InChI=1S/C34H48N4O6/c1-25(39)35-17-7-21-37(26(2)40)19-5-6-20-38-22-8-18-36-33(41)16-12-28-11-15-32(44-4)30(23-28)31(34(38)42)24-27-9-13-29(43-3)14-10-27/h9-11,13-15,23,31H,5-8,12,16-22,24H2,1-4H3,(H,35,39)(H,36,41)/t31-/m0/s1
InChIKey DJRDMKYNPOFREW-HKBQPEDESA-N
Mol Weight 608.8 g/mol
Molecular Formula C34H48N4O6
Exact Mass 608.357385 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1GUprLc5VAo
Name Acetamide, N-[3-(acetylamino)propyl]-N-[4-[15-methoxy-2-[(4-methoxyphenyl)methyl]-3,9-dioxo-4,8-diazabicyclo[10.3.1]hexadeca-1(16),12,14-trien-4-yl]b utyl]-, (S)-
CAS Registry Number 73710-90-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C34H48N4O6
InChI InChI=1S/C34H48N4O6/c1-25(39)35-17-7-21-37(26(2)40)19-5-6-20-38-22-8-18-36-33(41)16-12-28-11-15-32(44-4)30(23-28)31(34(38)42)24-27-9-13-29(43-3)14-10-27/h9-11,13-15,23,31H,5-8,12,16-22,24H2,1-4H3,(H,35,39)(H,36,41)/t31-/m0/s1
InChIKey DJRDMKYNPOFREW-HKBQPEDESA-N
Molecular Weight 608.780 g/mol
SMILES N1CCCN(CCCCN(CCCNC(=O)C)C(=O)C)C([C@](c2c(ccc(c2)CCC1=O)OC)(Cc1ccc(cc1)OC)[H])=O
SPLASH splash10-05fr-4921302000-7a2c697e3a6320adee8f
Source of Spectrum H-62-2722-0
Synonyms 4,8-Diazabicyclo[10.3.1]hexadecane, acetamide deriv. N(6),n(10)-diacetyl-o(16),o(34)(34)-dimethyl-10,11:16,17-diseco-orantin N,N'-diacetyl-O,O'-dimethyl-10,11:16,17-disecoorantine N-[3-(acetylamino)propyl]-N-{4-[(2S)-15-methoxy-2-(4-methoxybenzyl)-3,9-dioxo-4,8-diazabicyclo[10.3.1]hexadeca-1(16),12,14-trien-4-yl]butyl}acetamide
Wiley ID 1410753