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(1S,4R,4aS,11aR)-1,2,3,4,4a,11a-Hexahydro-1,4-methanobenzo[b]fluoren-11-one
SpectraBase Compound ID JckLn9V9I6f
InChI InChI=1S/C18H16O/c19-18-15-9-11-4-2-1-3-10(11)8-14(15)16-12-5-6-13(7-12)17(16)18/h1-4,8-9,12-13,16-17H,5-7H2/t12-,13+,16-,17-/m1/s1
InChIKey WALUJQVAXBXADW-DLTLXFJOSA-N
Mol Weight 248.32 g/mol
Molecular Formula C18H16O
Exact Mass 248.120115 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3euO2dANiS
Name (1S,4R,4aS,11aR)-1,2,3,4,4a,11a-Hexahydro-1,4-methanobenzo[b]fluoren-11-one
Appearance White solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H16O
InChI InChI=1S/C18H16O/c19-18-15-9-11-4-2-1-3-10(11)8-14(15)16-12-5-6-13(7-12)17(16)18/h1-4,8-9,12-13,16-17H,5-7H2/t12-,13+,16-,17-/m1/s1
InChIKey WALUJQVAXBXADW-DLTLXFJOSA-N
Instrument Name LRMS
Ionization Type EI
Literature Reference DOI 10.1002/chem.202001374
Molecular Weight 248.325 g/mol
SMILES c12c([C@@]3([C@](C2=O)([C@]2(CC[C@@]3(C2)[H])[H])[H])[H])cc2c(c1)cccc2
SPLASH splash10-001j-0930000000-240a2df3ca2c49d7a946
Source of Spectrum QE-26-SM6-20
Wiley ID 1841076