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6-Oxabicyclo[3.2.1]octan-7-one, 1,5-dimethyl-8-[2-[3-(1-methylethyl)phenyl]ethyl]-, (1R-syn)-
SpectraBase Compound ID KLFlTSo8tAZ
InChI InChI=1S/C20H28O2/c1-14(2)16-8-5-7-15(13-16)9-10-17-19(3)11-6-12-20(17,4)22-18(19)21/h5,7-8,13-14,17H,6,9-12H2,1-4H3/t17?,19-,20?/m1/s1
InChIKey HBVJEJOLVBVEHM-SKINQDTJSA-N
Mol Weight 300.44 g/mol
Molecular Formula C20H28O2
Exact Mass 300.20893 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Rab0Hr2FBI
Name 6-Oxabicyclo[3.2.1]octan-7-one, 1,5-dimethyl-8-[2-[3-(1-methylethyl)phenyl]ethyl]-, (1R-syn)-
CAS Registry Number 57119-17-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H28O2
InChI InChI=1S/C20H28O2/c1-14(2)16-8-5-7-15(13-16)9-10-17-19(3)11-6-12-20(17,4)22-18(19)21/h5,7-8,13-14,17H,6,9-12H2,1-4H3/t17?,19-,20?/m1/s1
InChIKey HBVJEJOLVBVEHM-SKINQDTJSA-N
Molecular Weight 300.442 g/mol
SMILES C1([C@]2(C(CCc3cc(C(C)C)ccc3)C(O1)(CCC2)C)C)=O
SPLASH splash10-0c00-0900000000-96ae1ff255363ef191bd
Source of Spectrum W5-0-0-0
Synonyms (1R)-8-[2-(3-isopropylphenyl)ethyl]-1,5-dimethyl-6-oxabicyclo[3.2.1]octan-7-one
Wiley ID 1303333