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[1SR,5RS,9SR,13SR,18RS]-18-methylhexacyclo[16.3.0.0(1,5).0(5,9).0(9,13).0(13,17)]henicos-16-ene
SpectraBase Compound ID 1asPZ5ZeejN
InChI InChI=1S/C22H32/c1-18-8-3-11-20(18)12-5-15-22(20)16-6-14-21(22)13-4-10-19(21)9-2-7-17(18)19/h7H,2-6,8-16H2,1H3/t18-,19+,20-,21+,22-/m1/s1
InChIKey JCVSGJCHWNQPTE-OQEHDIDLSA-N
Mol Weight 296.5 g/mol
Molecular Formula C22H32
Exact Mass 296.250401 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LEtVgmXT7nP
Name [1SR,5RS,9SR,13SR,18RS]-18-methylhexacyclo[16.3.0.0(1,5).0(5,9).0(9,13).0(13,17)]henicos-16-ene
CAS Registry Number 111614-40-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H32
InChI InChI=1S/C22H32/c1-18-8-3-11-20(18)12-5-15-22(20)16-6-14-21(22)13-4-10-19(21)9-2-7-17(18)19/h7H,2-6,8-16H2,1H3/t18-,19+,20-,21+,22-/m1/s1
InChIKey JCVSGJCHWNQPTE-OQEHDIDLSA-N
Molecular Weight 296.498 g/mol
SMILES C1=2[C@@]3([C@@]4(CCC3)CCC[C@]43[C@]4([C@@]1(CCC2)CCC4)CCC3)C
SPLASH splash10-0udi-0090000000-f48ae6eadfe6a15a1572
Source of Spectrum K-121-530-17
Synonyms 9a-methyl-2,3,5,6,7,8,9,9a,11,12,14,15-dodecahydro-1H,4H,13H-tricyclopenta[d,e,j]s-indacene
Wiley ID 1299808