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Tricyclo[3.3.1.1(3,7)]decane-1-carboxylic acid, 3,3'-methylenebis-
SpectraBase Compound ID 5zso9jlzG8c
InChI InChI=1S/C23H32O4/c24-18(25)22-7-14-1-15(8-22)4-20(3-14,12-22)11-21-5-16-2-17(6-21)10-23(9-16,13-21)19(26)27/h14-17H,1-13H2,(H,24,25)(H,26,27)/t14-,15?,16-,17?,20-,21-,22-,23-/m1/s1
InChIKey AXWMVEBNVKPYMB-ZHDNSFIDSA-N
Mol Weight 372.5 g/mol
Molecular Formula C23H32O4
Exact Mass 372.23006 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ETwE0ufQ2td
Name Tricyclo[3.3.1.1(3,7)]decane-1-carboxylic acid, 3,3'-methylenebis-
CAS Registry Number 77356-60-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H32O4
InChI InChI=1S/C23H32O4/c24-18(25)22-7-14-1-15(8-22)4-20(3-14,12-22)11-21-5-16-2-17(6-21)10-23(9-16,13-21)19(26)27/h14-17H,1-13H2,(H,24,25)(H,26,27)/t14-,15?,16-,17?,20-,21-,22-,23-/m1/s1
InChIKey AXWMVEBNVKPYMB-ZHDNSFIDSA-N
Molecular Weight 372.505 g/mol
SMILES OC([C@]12C[C@]3(C[C@@]45C[C@]6(C(=O)O)CC(C5)C[C@@](C6)(C4)[H])CC(C1)C[C@@](C2)(C3)[H])=O
SPLASH splash10-004i-0900000000-970831727a7bb6792eaa
Source of Spectrum K-114-658-0
Synonyms 3,3'-Methylenbis(1-adamantancarboxylic acid) 3-[(3-carboxy-1-adamantyl)methyl]-1-adamantanecarboxylic acid Bis(3-carboxy-1-adamantyl)methane
Wiley ID 1355716