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Longicyclene
SpectraBase Compound ID FUjH2zvn9rX
InChI InChI=1S/C15H24/c1-13(2)6-5-7-14(3)9-8-10-12(11(9)13)15(10,14)4/h9-12H,5-8H2,1-4H3/t9-,10+,11+,12+,14+,15+/m0/s1
InChIKey WCEIQUQVIOGRBF-RWBGOSSDSA-N
Mol Weight 204.36 g/mol
Molecular Formula C15H24
Exact Mass 204.187801 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Cm56dTQzX6K
Name Longicyclene
Source of Sample SAFC Cat.no. W522600
CAS Registry Number 1137-12-8
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 204.187800773 u
Formula C15H24
InChI InChI=1S/C15H24/c1-13(2)6-5-7-14(3)9-8-10-12(11(9)13)15(10,14)4/h9-12H,5-8H2,1-4H3/t9-,10+,11+,12+,14+,15+/m0/s1
InChIKey WCEIQUQVIOGRBF-RWBGOSSDSA-N
Molecular Weight 204.357 g/mol
Number of Peaks 50
RI1 1372
RI2 1050
SMILES [C@@]12([C@@]3([C@]4([C@@]3(C[C@@]1([C@]4(CCCC2(C)C)C)[H])[H])C)[H])[H]
SPLASH splash10-0006-9600000000-fdc429a5855292ff6a63
Sample Comments RI1: measured on SLB-5ms (Hydro) RI2: measured on SLB-5ms (FAMEs) RI3: measured on Supelcowax-10 (FAMEs) RI4: measured on Supelcowax-10 (FAEEs) RI5: measured on Equity-1 (Hydro)
Source of Spectrum Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy)
Synonyms 1,2,4-Methenoazulene, decahydro-1,5,5,8a-tetramethyl-, (1S,2R,3aR,4R,8aR,9S)-
Wiley ID LM_FFNSC3_1684