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Spiro[1,3-dioxolane-2,1'(8'aH)-naphthalene]-8'a-carboxylic acid, 4'-(benzoylamino)-2',3',4',4'a,5',8'-hexahydro-, methyl ester, [4'R-(4'.alpha.,4'a.alpha.,8'a.alpha.)]-
SpectraBase Compound ID 2UhwDGcokPz
InChI InChI=1S/C21H25NO5/c1-25-19(24)20-11-6-5-9-16(20)17(10-12-21(20)26-13-14-27-21)22-18(23)15-7-3-2-4-8-15/h2-8,16-17H,9-14H2,1H3,(H,22,23)/t16-,17+,20-/m0/s1
InChIKey FVHGFLFJFANPRP-QKLQHJQFSA-N
Mol Weight 371.43 g/mol
Molecular Formula C21H25NO5
Exact Mass 371.173273 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J6weij0jzik
Name Spiro[1,3-dioxolane-2,1'(8'aH)-naphthalene]-8'a-carboxylic acid, 4'-(benzoylamino)-2',3',4',4'a,5',8'-hexahydro-, methyl ester, [4'R-(4'.alpha.,4'a.alpha.,8'a.alpha.)]-
CAS Registry Number 96291-78-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H25NO5
InChI InChI=1S/C21H25NO5/c1-25-19(24)20-11-6-5-9-16(20)17(10-12-21(20)26-13-14-27-21)22-18(23)15-7-3-2-4-8-15/h2-8,16-17H,9-14H2,1H3,(H,22,23)/t16-,17+,20-/m0/s1
InChIKey FVHGFLFJFANPRP-QKLQHJQFSA-N
Molecular Weight 371.433 g/mol
SMILES N(C(=O)c1ccccc1)[C@]1([C@]2([C@](C3(OCCO3)CC1)(C(=O)OC)CC=CC2)[H])[H]
SPLASH splash10-0ab9-6900000000-418916451b49eb09ac40
Source of Spectrum J-50-1911-23
Synonyms (4R,9R,10R)-4-(benzoylamino)-9-(methoxycarbonyl)-cis->delta.(6)-1-octalone ethylene ketal Methyl (4'R,4'aR,8'aR)-4'-benzamido-3',4',4'a,5',8',8'a-hexahydro-2'H-spiro[1,3-dioxolane-2,1'-naphthalene]-8'a-carboxylate
Wiley ID 1355015