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4-n-Hexylresorcinol
SpectraBase Compound ID 6oWlNPEH7KB
InChI InChI=1S/C12H18O2/c1-2-3-4-5-6-10-7-8-11(13)9-12(10)14/h7-9,13-14H,2-6H2,1H3
InChIKey WFJIVOKAWHGMBH-UHFFFAOYSA-N
Mol Weight 194.27 g/mol
Molecular Formula C12H18O2
Exact Mass 194.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3ARwAGj6Ei
Name Hexylresorcinol
CAS Registry Number 136-77-6
Classification Antiseptic
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Exact Mass 194.130679818 u
Formula C12H18O2
InChI InChI=1S/C12H18O2/c1-2-3-4-5-6-10-7-8-11(13)9-12(10)14/h7-9,13-14H,2-6H2,1H3
InChIKey WFJIVOKAWHGMBH-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 194.274 g/mol
SMILES c1c(cc(c(c1)CCCCCC)O)O
SPLASH splash10-00di-4900000000-b2c09308a3c78fe7f363
Sample Comments The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database.
Sample Preparation Procedure Detected: P
Source of Spectrum H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany
Technique GC/MS
Wiley ID MMPW6e_1981