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(S)-(3R,5R,7R)-adamantan-1-yl 2-fluoro-1-oxo-2,3-dihydro-1H-indene-2-carboxylate
SpectraBase Compound ID 7pLVnrukqqC
InChI InChI=1S/C20H21FO3/c21-20(11-15-3-1-2-4-16(15)17(20)22)18(23)24-19-8-12-5-13(9-19)7-14(6-12)10-19/h1-4,12-14H,5-11H2/t12-,13+,14-,19-,20-/m0/s1
InChIKey NNLQYYOMCVHXIY-ZVVJOPMHSA-N
Mol Weight 328.38 g/mol
Molecular Formula C20H21FO3
Exact Mass 328.147473 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 54AcQeXbzTL
Name (S)-(3R,5R,7R)-adamantan-1-yl 2-fluoro-1-oxo-2,3-dihydro-1H-indene-2-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H21FO3
InChI InChI=1S/C20H21FO3/c21-20(11-15-3-1-2-4-16(15)17(20)22)18(23)24-19-8-12-5-13(9-19)7-14(6-12)10-19/h1-4,12-14H,5-11H2/t12-,13+,14-,19-,20-/m0/s1
InChIKey NNLQYYOMCVHXIY-ZVVJOPMHSA-N
Literature Reference DOI 10.1039/c4cc01631a
Molecular Weight 328.383 g/mol
SMILES C1C2(C[C@]3(C[C@@]1(C[C@](C3)(C2)[H])[H])[H])OC([C@@]1(Cc2ccccc2C1=O)F)=O
SPLASH splash10-000i-2900000000-1997cf775f7bf48e44a9
Source of Spectrum KD-50-7870/SMS23-5k
Wiley ID 1754627