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1,4-Epoxy-1H-dibenzo[a,c]cyclohepten-7(4H)-one, 4a,5,6,11b-tetrahydro-6,6-dimethyl-, [1R-(1.alpha.,4.alpha.,4a.alpha.,11b.beta.)]-
SpectraBase Compound ID Qn9BAgjMAa
InChI InChI=1S/C17H18O2/c1-17(2)9-12-13-7-8-14(19-13)15(12)10-5-3-4-6-11(10)16(17)18/h3-8,12-15H,9H2,1-2H3/t12-,13+,14-,15+/m1/s1
InChIKey ACWVHOLJGPMRKR-BARDWOONSA-N
Mol Weight 254.33 g/mol
Molecular Formula C17H18O2
Exact Mass 254.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7fp3h76iz1a
Name 1,4-Epoxy-1H-dibenzo[a,c]cyclohepten-7(4H)-one, 4a,5,6,11b-tetrahydro-6,6-dimethyl-, [1R-(1.alpha.,4.alpha.,4a.alpha.,11b.beta.)]-
Alternate Name(s) (1R,2R,12S,13S)-10,10-dimethyl-16-oxatetracyclo[11.2.1.0(2,12).0(3,8)]hexadeca-3,5,7,14-tetraen-9-one 1-endo-7-exo-5,5-dimethyl-2,3-benzo-12-oxatricyclo(5.4.0.1**8,11)dodec-2,9-dien-4-one
CAS Registry Number 64184-06-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H18O2
InChI InChI=1S/C17H18O2/c1-17(2)9-12-13-7-8-14(19-13)15(12)10-5-3-4-6-11(10)16(17)18/h3-8,12-15H,9H2,1-2H3/t12-,13+,14-,15+/m1/s1
InChIKey ACWVHOLJGPMRKR-BARDWOONSA-N
Molecular Weight 254.329 g/mol
SMILES [C@]12([C@](c3c(cccc3)C(C(C1)(C)C)=O)([C@]1([H])O[C@]2(C=C1)[H])[H])[H]
SPLASH splash10-000i-1900000000-f8d85d0d016e39202468
Source of Spectrum C-99-5079-0
Wiley ID 1258238