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1-Adamantyl 3-phenyl-2-phthalimidopropionate
SpectraBase Compound ID 4T3z7CIhMHa
InChI InChI=1S/C27H27NO4/c29-24-21-8-4-5-9-22(21)25(30)28(24)23(13-17-6-2-1-3-7-17)26(31)32-27-14-18-10-19(15-27)12-20(11-18)16-27/h1-9,18-20,23H,10-16H2/t18-,19+,20-,23?,27-
InChIKey BTXMZTWROTVEOU-BABRQVGDSA-N
Mol Weight 429.52 g/mol
Molecular Formula C27H27NO4
Exact Mass 429.194008 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1FiX2IFGyHb
Name 1-Adamantyl 3-phenyl-2-phthalimidopropionate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H27NO4
InChI InChI=1S/C27H27NO4/c29-24-21-8-4-5-9-22(21)25(30)28(24)23(13-17-6-2-1-3-7-17)26(31)32-27-14-18-10-19(15-27)12-20(11-18)16-27/h1-9,18-20,23H,10-16H2/t18-,19+,20-,23?,27-
InChIKey BTXMZTWROTVEOU-BABRQVGDSA-N
Molecular Weight 429.516 g/mol
SMILES c1ccc2c(c1)C(N(C2=O)C(C(=O)OC12C[C@]3(C[C@@](C2)(C[C@](C3)(C1)[H])[H])[H])Cc1ccccc1)=O
SPLASH splash10-002u-9400000000-255b6526d4c7329da3e6
Synonyms 1-Adamantyl 2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-3-phenylpropanoate 1-Adamantyl 2-(1,3-dioxoisoindol-2-yl)-3-phenylpropanoate 1-Adamantyl 2-(1,3-dioxoisoindolin-2-yl)-3-phenyl-propanoate 1-Adamantyl 2-[1,3-bis(oxidanylidene)isoindol-2-yl]-3-phenyl-propanoate 2-(1,3-dioxo-2-isoindolyl)-3-phenylpropanoic acid 1-adamantyl ester 3-Phenyl-2-phthalimido-propionic acid 1-adamantyl ester
Wiley ID 1470565