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Acetic acid (3aR,5S,6S)-6-acetyl-1-isopropyl-3a-methyl-3,3a,4,5,6,7-hexahydro-2H-inden-5-yl ester
SpectraBase Compound ID FEtETqlfUg9
InChI InChI=1S/C17H26O3/c1-10(2)13-6-7-17(5)9-16(20-12(4)19)14(11(3)18)8-15(13)17/h10,14,16H,6-9H2,1-5H3/t14-,16+,17-/m1/s1
InChIKey GGUUZEJIQGDFIO-HYVNUMGLSA-N
Mol Weight 278.39 g/mol
Molecular Formula C17H26O3
Exact Mass 278.188195 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID YMfopWnJhE
Name Acetic acid (3aR,5S,6S)-6-acetyl-1-isopropyl-3a-methyl-3,3a,4,5,6,7-hexahydro-2H-inden-5-yl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H26O3
InChI InChI=1S/C17H26O3/c1-10(2)13-6-7-17(5)9-16(20-12(4)19)14(11(3)18)8-15(13)17/h10,14,16H,6-9H2,1-5H3/t14-,16+,17-/m1/s1
InChIKey GGUUZEJIQGDFIO-HYVNUMGLSA-N
Molecular Weight 278.392 g/mol
SMILES C=12[C@@](C[C@@]([C@](C2)(C(=O)C)[H])(OC(=O)C)[H])(CCC1C(C)C)C
SPLASH splash10-00mo-5930000000-2bd562c2f0cd277929d9
Source of Spectrum QC-23-1043-8
Synonyms (5S,6S,7aR)-5-acetyl-3-isopropyl-7a-methyl-2,4,5,6,7,7a-hexahydro-1H-inden-6-yl acetate Acetic acid [(3aR,5S,6S)-6-acetyl-3a-methyl-1-propan-2-yl-2,3,4,5,6,7-hexahydroinden-5-yl] ester [(3aR,5S,6S)-6-acetyl-3a-methyl-1-propan-2-yl-2,3,4,5,6,7-hexahydroinden-5-yl] acetate [(3aR,5S,6S)-6-acetyl-1-isopropyl-3a-methyl-2,3,4,5,6,7-hexahydroinden-5-yl] acetate [(3aR,5S,6S)-6-ethanoyl-3a-methyl-1-propan-2-yl-2,3,4,5,6,7-hexahydroinden-5-yl] ethanoate
Wiley ID 1736905