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(1R,2S,3aS,4R,6aS)-1,3a,4,6a-tetramethyl-1,2,3,4,5,6-hexahydropentalene-2-carboxylic acid methyl ester
SpectraBase Compound ID Gk53yZLIfKF
InChI InChI=1S/C14H24O2/c1-9-6-7-13(3)10(2)11(12(15)16-5)8-14(9,13)4/h9-11H,6-8H2,1-5H3/t9-,10-,11+,13+,14+/m1/s1
InChIKey IKVQOUMDCDTKSQ-FQEAEBOJSA-N
Mol Weight 224.34 g/mol
Molecular Formula C14H24O2
Exact Mass 224.17763 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J64AaJQE3UC
Name (1R,2S,3aS,4R,6aS)-1,3a,4,6a-tetramethyl-1,2,3,4,5,6-hexahydropentalene-2-carboxylic acid methyl ester
Alternate Name(s) Methyl (1R,2S,3aS,4R,6aS)-1,3a,4,6a-tetramethyl-1,2,3,4,5,6-hexahydropentalene-2-carboxylate
CAS Registry Number 116215-00-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H24O2
InChI InChI=1S/C14H24O2/c1-9-6-7-13(3)10(2)11(12(15)16-5)8-14(9,13)4/h9-11H,6-8H2,1-5H3/t9-,10-,11+,13+,14+/m1/s1
InChIKey IKVQOUMDCDTKSQ-FQEAEBOJSA-N
Molecular Weight 224.344 g/mol
SMILES [C@@]12([C@@](C[C@@]([C@]2(C)[H])(C(=O)OC)[H])([C@](C)(CC1)[H])C)C
SPLASH splash10-0btc-9720000000-a6fb975c30b195168cc4
Source of Spectrum F-43-4883-13
Wiley ID 1225632