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(E)-2-Chloro-1-(o-hydroxyphenyl)-3-butylhept-1-en-3-ol
SpectraBase Compound ID 446b3oPUmNU
InChI InChI=1S/C17H25ClO2/c1-3-5-11-17(20,12-6-4-2)16(18)13-14-9-7-8-10-15(14)19/h7-10,13,19-20H,3-6,11-12H2,1-2H3/b16-13+
InChIKey AZZRETDDBDVKBK-DTQAZKPQSA-N
Mol Weight 296.84 g/mol
Molecular Formula C17H25ClO2
Exact Mass 296.154308 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2xatBI0p6SJ
Name (E)-2-Chloro-1-(o-hydroxyphenyl)-3-butylhept-1-en-3-ol
Comments Less than 3 mono-isotopic peaks
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Formula C17H25ClO2
InChI InChI=1S/C17H25ClO2/c1-3-5-11-17(20,12-6-4-2)16(18)13-14-9-7-8-10-15(14)19/h7-10,13,19-20H,3-6,11-12H2,1-2H3/b16-13+
InChIKey AZZRETDDBDVKBK-DTQAZKPQSA-N
Molecular Weight 296.838 g/mol
SMILES OC(\C(=C/c1c(cccc1)O)Cl)(CCCC)CCCC
SPLASH splash10-00di-0090000000-dfcb9b3f73ac59b547b3
Source of Spectrum KC-1991-208-9
Synonyms 2-[(1E)-3-butyl-2-chloro-3-hydroxy-1-heptenyl]phenol
Wiley ID 1299164