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1-Benzyl-6,7-bis(methoxycarbonyl)-3-phenyl-hexahydroimidazo[1,2-b]isoxazole
SpectraBase Compound ID 1RLoCtRSeui
InChI InChI=1S/C22H24N2O5/c1-27-21(25)18-19(22(26)28-2)29-24-17(16-11-7-4-8-12-16)14-23(20(18)24)13-15-9-5-3-6-10-15/h3-12,17-20H,13-14H2,1-2H3/t17-,18+,19+,20+/m1/s1
InChIKey VYXNKMHFGUGKBG-FYQPLNBISA-N
Mol Weight 396.44 g/mol
Molecular Formula C22H24N2O5
Exact Mass 396.168522 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KjFoa7bxx5C
Name 1-Benzyl-6,7-bis(methoxycarbonyl)-3-phenyl-hexahydroimidazo[1,2-b]isoxazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H24N2O5
InChI InChI=1S/C22H24N2O5/c1-27-21(25)18-19(22(26)28-2)29-24-17(16-11-7-4-8-12-16)14-23(20(18)24)13-15-9-5-3-6-10-15/h3-12,17-20H,13-14H2,1-2H3/t17-,18+,19+,20+/m1/s1
InChIKey VYXNKMHFGUGKBG-FYQPLNBISA-N
Molecular Weight 396.443 g/mol
SMILES [C@]12(N(O[C@@]([C@@]2(C(=O)OC)[H])(C(=O)OC)[H])[C@](CN1Cc1ccccc1)(c1ccccc1)[H])[H]
SPLASH splash10-0a4i-9600000000-c45b963d93598e7eae08
Source of Spectrum D1-2000-970-8
Synonyms (3S,6S,7R,7aS)-1-Benzyl-6,7-bis(methoxycarbonyl)-3-phenyl-hexahydroimidazo[1,2-b]isoxazole Dimethyl 1-benzyl-3-phenylhexahydroimidazo[1,2-b]isoxazole-6,7-dicarboxylate (3S,6S,7R,7aS)-3-phenyl-1-(phenylmethyl)-3,6,7,7a-tetrahydro-2H-imidazo[1,2-b]isoxazole-6,7-dicarboxylic acid dimethyl ester Dimethyl (3S,6S,7R,7aS)-1-benzyl-3-phenyl-3,6,7,7a-tetrahydro-2H-imidazo[1,2-b][1,2]oxazole-6,7-dicarboxylate Dimethyl (3S,6S,7R,7aS)-1-benzyl-3-phenyl-3,6,7,7a-tetrahydro-2H-imidazo[1,2-b]isoxazole-6,7-dicarboxylate Dimethyl (3S,6S,7R,7aS)-3-phenyl-1-(phenylmethyl)-3,6,7,7a-tetrahydro-2H-imidazo[1,2-b][1,2]oxazole-6,7-dicarboxylate
Wiley ID 835430