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1,4-Epoxy-1H-dibenzo[a,c]cyclohepten-7(4H)-one, 4a,5,6,11b-tetrahydro-5,5-dimethyl-, (1.alpha.,4.alpha.,4a.alpha.,11b.beta.)-
SpectraBase Compound ID 3jwsWivV7Xu
InChI InChI=1S/C17H18O2/c1-17(2)9-12(18)10-5-3-4-6-11(10)15-13-7-8-14(19-13)16(15)17/h3-8,13-16H,9H2,1-2H3/t13-,14+,15-,16-/m1/s1
InChIKey VWLFEZMFFURBLU-QKPAOTATSA-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 1HW4n4568m3
Name 1,4-Epoxy-1H-dibenzo[a,c]cyclohepten-7(4H)-one, 4a,5,6,11b-tetrahydro-5,5-dimethyl-, (1.alpha.,4.alpha.,4a.alpha.,11b.beta.)-
CAS Registry Number 64396-28-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H18O2
InChI InChI=1S/C17H18O2/c1-17(2)9-12(18)10-5-3-4-6-11(10)15-13-7-8-14(19-13)16(15)17/h3-8,13-16H,9H2,1-2H3/t13-,14+,15-,16-/m1/s1
InChIKey VWLFEZMFFURBLU-QKPAOTATSA-N
Molecular Weight 254.329 g/mol
SMILES [C@]12(c3c(C(=O)CC([C@@]2([C@@]2(C=C[C@]1(O2)[H])[H])[H])(C)C)cccc3)[H]
SPLASH splash10-0076-0900000000-4732127a38f46e1c4cac
Source of Spectrum C-99-5078-0
Synonyms (1R,2R,12R,13S)-11,11-dimethyl-16-oxatetracyclo[11.2.1.0(2,12).0(3,8)]hexadeca-3,5,7,14-tetraen-9-one 1-exo-7-endo-6,6-dimethyl-2,3-benzo-12-oxatricyclo(5.4.0.1**8,11)dodec-2,9-dien-4-one
Wiley ID 1258235