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(3S,4R)-4-methyl-1'-spiro[2,4,5,6,7,8,9,10-octahydro-1H-benzo[8]annulene-3,2'-cyclopentane]one
SpectraBase Compound ID 82SASn71ZFt
InChI InChI=1S/C17H26O/c1-13-15-8-5-3-2-4-7-14(15)10-12-17(13)11-6-9-16(17)18/h13H,2-12H2,1H3/t13-,17+/m1/s1
InChIKey OFXTZQZJTMEYNB-DYVFJYSZSA-N
Mol Weight 246.39 g/mol
Molecular Formula C17H26O
Exact Mass 246.198365 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CUObC2CihYN
Name (3S,4R)-4-methyl-1'-spiro[2,4,5,6,7,8,9,10-octahydro-1H-benzo[8]annulene-3,2'-cyclopentane]one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H26O
InChI InChI=1S/C17H26O/c1-13-15-8-5-3-2-4-7-14(15)10-12-17(13)11-6-9-16(17)18/h13H,2-12H2,1H3/t13-,17+/m1/s1
InChIKey OFXTZQZJTMEYNB-DYVFJYSZSA-N
Molecular Weight 246.394 g/mol
SMILES [C@]12([C@@](C=3CCCCCCC3CC2)(C)[H])C(=O)CCC1
SPLASH splash10-052f-5930000000-2a2989b140b48422ae3b
Source of Spectrum F4-0-2221-20
Synonyms (3S,4R)-4-methylspiro[2,4,5,6,7,8,9,10-octahydro-1H-benzocyclooctene-3,2'-cyclopentane]-1'-one (3S,4R)-4-methylspiro[2,4,5,6,7,8,9,10-octahydro-1H-benzo[8]annulene-3,2'-cyclopentane]-1'-one
Wiley ID 1620109