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(7R,5aR,9aS)-7-Isopropyl-9a-methylchromeno[2,3-e]cyclohex-8-en-4-one
SpectraBase Compound ID 24wicrk54fv
InChI InChI=1S/C17H24O2/c1-11(2)12-7-8-17(3)13(9-12)10-14-15(18)5-4-6-16(14)19-17/h7-8,11-13H,4-6,9-10H2,1-3H3/t12-,13-,17-/m1/s1
InChIKey ZKUHJRMSWMCDTA-PBFPGSCMSA-N
Mol Weight 260.38 g/mol
Molecular Formula C17H24O2
Exact Mass 260.17763 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KTHA0QccMcS
Name (7R,5aR,9aS)-7-Isopropyl-9a-methylchromeno[2,3-e]cyclohex-8-en-4-one
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H24O2
InChI InChI=1S/C17H24O2/c1-11(2)12-7-8-17(3)13(9-12)10-14-15(18)5-4-6-16(14)19-17/h7-8,11-13H,4-6,9-10H2,1-3H3/t12-,13-,17-/m1/s1
InChIKey ZKUHJRMSWMCDTA-PBFPGSCMSA-N
Molecular Weight 260.377 g/mol
SMILES C12=C(O[C@]3([C@@](C2)(C[C@@](C=C3)(C(C)C)[H])[H])C)CCCC1=O
SPLASH splash10-001r-9200000000-98b032749d459a82d66c
Source of Spectrum AT-31-6632-5
Synonyms (5aR,7R,9aS)-7-Isopropyl-9a-methylchromeno[2,3-e]cyclohex-8-en-4-one (7R,8aR,10aS)-7-isopropyl-10a-methyl-2,3,4,7,8,8a,9,10a-octahydro-1H-xanthen-1-one 7-Isopropyl-9a-methylchromeno[2,3-e]cyclohex-8-en-4-one
Wiley ID 835826