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(1R,1'S,3'S)-1,3'-dimethyl-3,4,5,6,7,8,9,10-octahydro-1H-spiro[benzo[8]annulene-2,1'-cyclopentan]-2'-one

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(1R,1'S,3'S)-1,3'-dimethyl-3,4,5,6,7,8,9,10-octahydro-1H-spiro[benzo[8]annulene-2,1'-cyclopentan]-2'-one
SpectraBase Compound ID 2xZJi3LSw2k
InChI InChI=1S/C18H28O/c1-13-9-11-18(17(13)19)12-10-15-7-5-3-4-6-8-16(15)14(18)2/h13-14H,3-12H2,1-2H3/t13-,14+,18-/m0/s1
InChIKey RVMUGSHXIUENTG-IYOUNJFTSA-N
Mol Weight 260.42 g/mol
Molecular Formula C18H28O
Exact Mass 260.214016 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A5hbQHDm6Ab
Name (1R,1'S,3'S)-1,3'-dimethyl-3,4,5,6,7,8,9,10-octahydro-1H-spiro[benzo[8]annulene-2,1'-cyclopentan]-2'-one
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H28O
InChI InChI=1S/C18H28O/c1-13-9-11-18(17(13)19)12-10-15-7-5-3-4-6-8-16(15)14(18)2/h13-14H,3-12H2,1-2H3/t13-,14+,18-/m0/s1
InChIKey RVMUGSHXIUENTG-IYOUNJFTSA-N
Literature Reference DOI 10.1002/cbdv.200890108
Molecular Weight 260.421 g/mol
SMILES C1CCCC2=C(CC1)CC[C@]1([C@@]2(C)[H])CC[C@@](C1=O)(C)[H]
SPLASH splash10-0006-5920000000-f64646883e2b485ec90c
Source of Spectrum CBD-5-997-101
Synonyms (1R,2S,3'S)-1,3'-dimethyl-3,4,5,6,7,8,9,10-octahydro-1H-spiro[benzo[8]annulene-2,1'-cyclopentan]-2'-one
Wiley ID 1806333