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(2S,4aR)-3-oxooctahydro-1H-2,4a-ethanonaphthalen-7-yl benzoate
SpectraBase Compound ID Ff9K9sL8TOL
InChI InChI=1S/C19H22O3/c20-17-12-19-8-6-14(17)10-15(19)11-16(7-9-19)22-18(21)13-4-2-1-3-5-13/h1-5,14-16H,6-12H2/t14-,15-,16?,19+/m0/s1
InChIKey KBDZZBYIGWFDOE-CJEYDRFVSA-N
Mol Weight 298.38 g/mol
Molecular Formula C19H22O3
Exact Mass 298.156895 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EcJX78lTfpj
Name (2S,4aR)-3-oxooctahydro-1H-2,4a-ethanonaphthalen-7-yl benzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H22O3
InChI InChI=1S/C19H22O3/c20-17-12-19-8-6-14(17)10-15(19)11-16(7-9-19)22-18(21)13-4-2-1-3-5-13/h1-5,14-16H,6-12H2/t14-,15-,16?,19+/m0/s1
InChIKey KBDZZBYIGWFDOE-CJEYDRFVSA-N
Literature Reference DOI 10.1021/ol801647h
Molecular Weight 298.382 g/mol
SMILES C1(C[C@@]2(C[C@@]3(CC[C@@]2(CC1)CC3=O)[H])[H])OC(=O)c1ccccc1
SPLASH splash10-056r-1900000000-3d4b5c750dfdb98956d2
Source of Spectrum A1-10-4465/SMS20-20
Wiley ID 1759817