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1,3-Benzenediol, 5-hexyl-
SpectraBase Compound ID 3ap7WualGY6
InChI InChI=1S/C12H18O2/c1-2-3-4-5-6-10-7-11(13)9-12(14)8-10/h7-9,13-14H,2-6H2,1H3
InChIKey XECRVULUEJSGBY-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 1BLj1AwbIy1
Name 1,3-Benzenediol, 5-hexyl-
Alternate Name(s) 5-Hexyl-1,3-benzenediol 1,3-Dihydroxy-5-hexylbenzene 5-Hexylbenzene-1,3-diol 5-Hexylresorcinol
CAS Registry Number 5465-20-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18O2
InChI InChI=1S/C12H18O2/c1-2-3-4-5-6-10-7-11(13)9-12(14)8-10/h7-9,13-14H,2-6H2,1H3
InChIKey XECRVULUEJSGBY-UHFFFAOYSA-N
Molecular Weight 194.274 g/mol
SMILES Oc1cc(cc(O)c1)CCCCCC
SPLASH splash10-00di-2900000000-0b4a2c04f6fa7f8edfd9
Source of Spectrum JZ-1992-4448-0
Wiley ID 1191099