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Phenanthrene, 1,2,3,4,4a,9,10,10a-octahydro-1,1,4a-trimethyl-7-(1-methylethyl)-, (4aS-trans)-
SpectraBase Compound ID 4GZ0lqFNKe6
InChI InChI=1S/C20H30/c1-14(2)15-7-9-17-16(13-15)8-10-18-19(3,4)11-6-12-20(17,18)5/h7,9,13-14,18H,6,8,10-12H2,1-5H3
InChIKey QUUCYKKMFLJLFS-UHFFFAOYSA-N
Mol Weight 270.46 g/mol
Molecular Formula C20H30
Exact Mass 270.234751 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HVqXpZx9JW2
Name Abietatriene
CAS Registry Number 19407-28-4
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 270.234750966 u
Formula C20H30
InChI InChI=1S/C20H30/c1-14(2)15-7-9-17-16(13-15)8-10-18-19(3,4)11-6-12-20(17,18)5/h7,9,13-14,18H,6,8,10-12H2,1-5H3
InChIKey QUUCYKKMFLJLFS-UHFFFAOYSA-N
Molecular Weight 270.460 g/mol
Number of Peaks 50
RI1 2058
SMILES C12(C(C(C)(C)CCC2)CCc2c1ccc(C(C)C)c2)C
SPLASH splash10-0ab9-5930000000-e2abf546276b1b64441a
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 Phenanthrene, 1,2,3,4,4a,9,10,10a-octahydro-1,1,4a-trimethyl-7-(1-methylethyl)-
Wiley ID LM_FFNSC3_2686