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(3S,5S,6R,7S,7aS)-1-Benzyl-5,7-bis(methoxymethyl)-6-(2-methoxyethyl)-3-phenylhexahydropyrrolo[1,2-a]imidazole
SpectraBase Compound ID KVBhTLNe3eX
InChI InChI=1S/C26H36N2O3/c1-29-15-14-22-23(18-30-2)26-27(16-20-10-6-4-7-11-20)17-24(21-12-8-5-9-13-21)28(26)25(22)19-31-3/h4-13,22-26H,14-19H2,1-3H3/t22-,23+,24-,25-,26+/m1/s1
InChIKey JNUWGNSPTRYIHN-OAQXCZEZSA-N
Mol Weight 424.6 g/mol
Molecular Formula C26H36N2O3
Exact Mass 424.272593 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DOZHtPKWmZb
Name (3S,5S,6R,7S,7aS)-1-Benzyl-5,7-bis(methoxymethyl)-6-(2-methoxyethyl)-3-phenylhexahydropyrrolo[1,2-a]imidazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H36N2O3
InChI InChI=1S/C26H36N2O3/c1-29-15-14-22-23(18-30-2)26-27(16-20-10-6-4-7-11-20)17-24(21-12-8-5-9-13-21)28(26)25(22)19-31-3/h4-13,22-26H,14-19H2,1-3H3/t22-,23+,24-,25-,26+/m1/s1
InChIKey JNUWGNSPTRYIHN-OAQXCZEZSA-N
Molecular Weight 424.585 g/mol
SMILES [C@@]12(N([C@](CN2Cc2ccccc2)(c2ccccc2)[H])[C@@]([C@@]([C@@]1(COC)[H])(CCOC)[H])(COC)[H])[H]
SPLASH splash10-01ox-6192200000-e195dfed65af6f737754
Source of Spectrum F-67-8936-25
Wiley ID 1691122