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(3aR,3bS,6aS,7aS)-3a,5,5,7a-Tetramethyldecahydrocyclopenta[a]pentalene-1,1-dicarboxylic acid
SpectraBase Compound ID LAqwLmNhF7y
InChI InChI=1S/C17H26O4/c1-14(2)7-10-8-16(4)15(3,11(10)9-14)5-6-17(16,12(18)19)13(20)21/h10-11H,5-9H2,1-4H3,(H,18,19)(H,20,21)/t10-,11-,15+,16-/m0/s1
InChIKey DKYRSRHAHNVKKD-QMMBQJITSA-N
Mol Weight 294.39 g/mol
Molecular Formula C17H26O4
Exact Mass 294.183109 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K1tudgg0wiY
Name (3aR,3bS,6aS,7aS)-3a,5,5,7a-Tetramethyldecahydrocyclopenta[a]pentalene-1,1-dicarboxylic acid
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H26O4
InChI InChI=1S/C17H26O4/c1-14(2)7-10-8-16(4)15(3,11(10)9-14)5-6-17(16,12(18)19)13(20)21/h10-11H,5-9H2,1-4H3,(H,18,19)(H,20,21)/t10-,11-,15+,16-/m0/s1
InChIKey DKYRSRHAHNVKKD-QMMBQJITSA-N
Molecular Weight 294.391 g/mol
SMILES OC(C1(C(=O)O)[C@@]2([C@@]([C@]3(CC(C[C@]3(C2)[H])(C)C)[H])(CC1)C)C)=O
SPLASH splash10-03di-0900000000-8c931d24bdb1ec77b338
Source of Spectrum F-54-10717-14
Synonyms (3aR,3bS,6aS,7aS)-3a,5,5,7a-tetramethyldecahydro-1H-cyclopenta[a]pentalene-1,1-dicarboxylic acid (3aSR,3bRS,6aRS,7aSR)-3a,5,5,7a-Tetramethyldecahydrocyclopenta[a]pentalene-1,1-dicarboxylic acid
Wiley ID 808689