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3-bromanyl-2-heptadecyl-6-methoxy-phenol
SpectraBase Compound ID It8hstMc8D1
InChI InChI=1S/C24H41BrO2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-22(25)19-20-23(27-2)24(21)26/h19-20,26H,3-18H2,1-2H3
InChIKey XTPWBHHYFQUSJH-UHFFFAOYSA-N
Mol Weight 441.5 g/mol
Molecular Formula C24H41BrO2
Exact Mass 440.228994 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JknS51V4WyV
Name 3-bromanyl-2-heptadecyl-6-methoxy-phenol
Alternate Name(s) 3-bromo-2-heptadecyl-6-methoxy-phenol
Comments Less than 3 mono-isotopic peaks
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Formula C24H41BrO2
InChI InChI=1S/C24H41BrO2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21-22(25)19-20-23(27-2)24(21)26/h19-20,26H,3-18H2,1-2H3
InChIKey XTPWBHHYFQUSJH-UHFFFAOYSA-N
Molecular Weight 441.494 g/mol
SMILES Oc1c(ccc(c1CCCCCCCCCCCCCCCCC)Br)OC
SPLASH splash10-0006-0010900000-8ee84c7568a43c773ece
Source of Spectrum E2-46-1692-6
Wiley ID 1554574