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Bromolaurenisol
SpectraBase Compound ID 7Sezy9r46eu
InChI InChI=1S/C15H18Br2O/c1-9-6-14(18)12(7-13(9)17)15(3)5-4-11(8-16)10(15)2/h6-8,10,18H,4-5H2,1-3H3/b11-8-/t10-,15+/m0/s1
InChIKey DVSNCQPMSPUOAI-KGNMDHSFSA-N
Mol Weight 374.12 g/mol
Molecular Formula C15H18Br2O
Exact Mass 371.972441 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 66q92omikmw
Name Bromolaurenisol
CAS Registry Number 72782-83-3
Copyright Database Compilation Copyright © 2023-2025 John Wiley and Sons, Inc. Copyright © 2023-2025 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 371.972441199 u
Formula C15H18Br2O
InChI InChI=1S/C15H18Br2O/c1-9-6-14(18)12(7-13(9)17)15(3)5-4-11(8-16)10(15)2/h6-8,10,18H,4-5H2,1-3H3/b11-8-/t10-,15+/m0/s1
InChIKey DVSNCQPMSPUOAI-KGNMDHSFSA-N
Molecular Weight 374.116 g/mol
Number of Peaks 50
RI1 2428
RI2 2101
SMILES Oc1cc(c(cc1[C@@]1(C)[C@](\C(CC1)=C/Br)(C)[H])Br)C
SPLASH splash10-03dm-5981000000-a3cc89701af114c5bc20
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 Phenol, 4-bromo-2-[(1R,2R,3Z)-3-(bromomethylene)-1,2-dimethylcyclopentyl]-5-methyl-
Wiley ID LM_FFNSC3_2034