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Cyclopenta[c]pentalene-4-carboxylic acid, decahydro-1,3a,5a-trimethyl-, methyl ester, (1.alpha.,3a.alpha.,4.beta.,5a.beta.,8aR*)-(.+-.)-
SpectraBase Compound ID HVZJZPjr3no
InChI InChI=1S/C16H26O2/c1-11-6-9-15(3)12(13(17)18-4)10-14(2)7-5-8-16(11,14)15/h11-12H,5-10H2,1-4H3/t11-,12-,14+,15+,16-/m1/s1
InChIKey KSSYUKUTNNEEQV-DMVVEVTLSA-N
Mol Weight 250.38 g/mol
Molecular Formula C16H26O2
Exact Mass 250.19328 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4H3pLLLXLel
Name Cyclopenta[c]pentalene-4-carboxylic acid, decahydro-1,3a,5a-trimethyl-, methyl ester, (1.alpha.,3a.alpha.,4.beta.,5a.beta.,8aR*)-(.+-.)-
CAS Registry Number 71596-70-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H26O2
InChI InChI=1S/C16H26O2/c1-11-6-9-15(3)12(13(17)18-4)10-14(2)7-5-8-16(11,14)15/h11-12H,5-10H2,1-4H3/t11-,12-,14+,15+,16-/m1/s1
InChIKey KSSYUKUTNNEEQV-DMVVEVTLSA-N
Molecular Weight 250.382 g/mol
SMILES [C@]12([C@@]3([C@](CCC3)(C)C[C@@]1(C(=O)OC)[H])[C@](C)(CC2)[H])C
SPLASH splash10-0udi-0960000000-df16dbe01f2b6f92018e
Source of Spectrum F-37-4363-0
Synonyms Methyl (1R,3aS,4S,5aS,8aR)-1,3a,5a-trimethyldecahydrocyclopenta[c]pentalene-4-carboxylate Methylester of decahydro-1,3a,5a-trimethyl-cyclopenta[c]pentalene-4-carboxylic acid
Wiley ID 1253898