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(-)-(1aR,4aS,7R,7aR,7bS)-decahydro-4-methylene-1,1,7-trimethyl-1H-cycloprop[e]azulene
SpectraBase Compound ID 7DfBiyM5yvM
InChI InChI=1S/C15H24/c1-9-6-8-12-14(15(12,3)4)13-10(2)5-7-11(9)13/h10-14H,1,5-8H2,2-4H3/t10-,11-,12-,13-,14-/m1/s1
InChIKey ITYNGVSTWVVPIC-DHGKCCLASA-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 lBB0HnQa8k
Name Alloaromadendrene
Source of Sample SAFC Cat.no. W290106
CAS Registry Number 25246-27-9
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/c1-9-6-8-12-14(15(12,3)4)13-10(2)5-7-11(9)13/h10-14H,1,5-8H2,2-4H3/t10-,11-,12-,13-,14-/m1/s1
InChIKey ITYNGVSTWVVPIC-DHGKCCLASA-N
Molecular Weight 204.357 g/mol
Number of Peaks 47
RI1 1458
RI2 1127
RI3 1042
RI4 1398
SMILES [C@@]12([C@@](C(CC[C@@]3([C@]2(C3(C)C)[H])[H])=C)(CC[C@]1(C)[H])[H])[H]
SPLASH splash10-052f-9700000000-b20c2001af34d9f316fe
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 1H-Cycloprop[e]azulene, decahydro-1,1,7-trimethyl-4-methylene-, (1aR,4aS,7R,7aR,7bS)-
Wiley ID LM_FFNSC3_1068