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(1S,2S,6S,7R)-Methyl 7-(benzyl(tert-butoxycarbonyl)amino)-1-hydroxyspiro[5.5]undec-8-ene-2-carboxylate
SpectraBase Compound ID Gztc7n95CgC
InChI InChI=1S/C25H35NO5/c1-24(2,3)31-23(29)26(17-18-11-6-5-7-12-18)20-14-8-9-15-25(20)16-10-13-19(21(25)27)22(28)30-4/h5-8,11-12,14,19-21,27H,9-10,13,15-17H2,1-4H3/t19-,20+,21-,25+/m0/s1
InChIKey BYOIQJBHTRLFSJ-UGCAPWQASA-N
Mol Weight 429.6 g/mol
Molecular Formula C25H35NO5
Exact Mass 429.251523 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7sCZArYPois
Name (1S,2S,6S,7R)-Methyl 7-(benzyl(tert-butoxycarbonyl)amino)-1-hydroxyspiro[5.5]undec-8-ene-2-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H35NO5
InChI InChI=1S/C25H35NO5/c1-24(2,3)31-23(29)26(17-18-11-6-5-7-12-18)20-14-8-9-15-25(20)16-10-13-19(21(25)27)22(28)30-4/h5-8,11-12,14,19-21,27H,9-10,13,15-17H2,1-4H3/t19-,20+,21-,25+/m0/s1
InChIKey BYOIQJBHTRLFSJ-UGCAPWQASA-N
Molecular Weight 429.557 g/mol
SMILES O[C@@]1([C@@]2([C@](N(C(OC(C)(C)C)=O)Cc3ccccc3)(C=CCC2)[H])CCC[C@@]1(C(=O)OC)[H])[H]
SPLASH splash10-00e9-0492200000-dc94943888f054a102a1
Source of Spectrum F-67-7995-30
Wiley ID 1687602