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phenyl-[(4R,5R)-2,4,5-trimorpholin-4-yl-4,5-dihydroimidazol-1-yl]methanone
SpectraBase Compound ID HXLcxbKzfC3
InChI InChI=1S/C22H31N5O4/c28-21(18-4-2-1-3-5-18)27-20(25-8-14-30-15-9-25)19(24-6-12-29-13-7-24)23-22(27)26-10-16-31-17-11-26/h1-5,19-20H,6-17H2/t19-,20+/m0/s1
InChIKey ZWYKYIALQRWFPE-VQTJNVASSA-N
Mol Weight 429.52 g/mol
Molecular Formula C22H31N5O4
Exact Mass 429.237604 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KlmfT56k0DT
Name phenyl-[(4R,5R)-2,4,5-trimorpholin-4-yl-4,5-dihydroimidazol-1-yl]methanone
CAS Registry Number 74362-12-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H31N5O4
InChI InChI=1S/C22H31N5O4/c28-21(18-4-2-1-3-5-18)27-20(25-8-14-30-15-9-25)19(24-6-12-29-13-7-24)23-22(27)26-10-16-31-17-11-26/h1-5,19-20H,6-17H2/t19-,20+/m0/s1
InChIKey ZWYKYIALQRWFPE-VQTJNVASSA-N
Molecular Weight 429.521 g/mol
SMILES C=1(N([C@]([C@@](N1)(N1CCOCC1)[H])(N1CCOCC1)[H])C(=O)c1ccccc1)N1CCOCC1
SPLASH splash10-00di-2739000000-d489d1cea3225b71ca53
Source of Spectrum Y-17-99-0
Synonyms phenyl-[(4R,5R)-2,4,5-trimorpholino-2-imidazolin-1-yl]methanone phenyl-[(4R,5R)-2,4,5-trimorpholino-4,5-dihydroimidazol-1-yl]methanone phenyl-[(4R,5R)-2,4,5-tris(4-morpholinyl)-4,5-dihydroimidazol-1-yl]methanone
Wiley ID 1381165