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1,4-Cyclohexane dimethanol
SpectraBase Compound ID F6X1QvFPZPs
InChI InChI=1S/C8H16O2/c9-5-7-1-2-8(6-10)4-3-7/h7-10H,1-6H2
InChIKey YIMQCDZDWXUDCA-UHFFFAOYSA-N
Mol Weight 144.21 g/mol
Molecular Formula C8H16O2
Exact Mass 144.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8FFpXPXLdtA
Name 1,4-Cyclohexanedimethanol
CAS Registry Number 3236-47-3
Classification Chemical
Comments Spectrum verified by crosschecking against external libraries (one reference spectrum with similarity >= 99% found); Spectrum verified by independent measurements in external laboratories
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 144.115029753 u
Formula C8H16O2
InChI InChI=1S/C8H16O2/c9-5-7-1-2-8(6-10)4-3-7/h7-10H,1-6H2
InChIKey YIMQCDZDWXUDCA-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 144.214 g/mol
Nominal Mass 144 u
Quality 941
Retention Index 1031
SMILES OCC1CCC(CO)CC1
SPLASH splash10-0005-9000000000-cee857b4078e3708b0f6
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms (4-(Hydroxymethyl)cyclohexyl)methanol
Technique GC/MS
Wiley ID DD2024_030849