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Acetic acid (3aRS,7aSR)-3-Furan-3-yl-3a,7,7-trimethyl-1-oxo-3a,6,7,7a-tetrahydro-1H-inden-4-yl ester
SpectraBase Compound ID 1StFhipLWQa
InChI InChI=1S/C18H20O4/c1-11(19)22-15-5-7-17(2,3)16-14(20)9-13(18(15,16)4)12-6-8-21-10-12/h5-6,8-10,16H,7H2,1-4H3/t16-,18+/m0/s1
InChIKey XOMBAGZYYZSTDO-FUHWJXTLSA-N
Mol Weight 300.35 g/mol
Molecular Formula C18H20O4
Exact Mass 300.136159 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8JkB7FGdZgF
Name Acetic acid (3aRS,7aSR)-3-Furan-3-yl-3a,7,7-trimethyl-1-oxo-3a,6,7,7a-tetrahydro-1H-inden-4-yl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H20O4
InChI InChI=1S/C18H20O4/c1-11(19)22-15-5-7-17(2,3)16-14(20)9-13(18(15,16)4)12-6-8-21-10-12/h5-6,8-10,16H,7H2,1-4H3/t16-,18+/m0/s1
InChIKey XOMBAGZYYZSTDO-FUHWJXTLSA-N
Molecular Weight 300.354 g/mol
SMILES [C@]12(C(=CC([C@]2(C(CC=C1OC(=O)C)(C)C)[H])=O)c1cocc1)C
SPLASH splash10-08fr-6920000000-7afef3fc4316c569f3ba
Source of Spectrum KC-57-1055-9
Wiley ID 1622831