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Methyl 4-(3-phenylbicyclo[2.2.1]heptan-2-yl)benzoate
SpectraBase Compound ID CvzYH77n3Cr
InChI InChI=1S/C21H22O2/c1-23-21(22)16-9-7-15(8-10-16)20-18-12-11-17(13-18)19(20)14-5-3-2-4-6-14/h2-10,17-20H,11-13H2,1H3/t17-,18+,19-,20-/m0/s1
InChIKey TUVCCMOCJDXNLR-YRPNKDGESA-N
Mol Weight 306.41 g/mol
Molecular Formula C21H22O2
Exact Mass 306.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GLYKqGU5tEM
Name Methyl 4-(3-phenylbicyclo[2.2.1]heptan-2-yl)benzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H22O2
InChI InChI=1S/C21H22O2/c1-23-21(22)16-9-7-15(8-10-16)20-18-12-11-17(13-18)19(20)14-5-3-2-4-6-14/h2-10,17-20H,11-13H2,1H3/t17-,18+,19-,20-/m0/s1
InChIKey TUVCCMOCJDXNLR-YRPNKDGESA-N
Literature Reference DOI 10.1002/cctc.201800940
Molecular Weight 306.405 g/mol
SMILES c1(ccc(cc1)[C@]1([C@@]2(CC[C@@](C2)([C@@]1(c1ccccc1)[H])[H])[H])[H])C(OC)=O
SPLASH splash10-0ar0-0849000000-0e582c4e9cfa2d48fa8c
Source of Spectrum CCC-10-SM23-9
Synonyms Methyl 4-((1R,2S,4S)-3-phenylbicyclo[2.2.1]heptan-2-yl)benzoate
Wiley ID 1812713