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7-HYDROXYMENTHOL
SpectraBase Compound ID 3AQ8U1t1iX0
InChI InChI=1S/C10H20O2/c1-7-4-5-8(9(11)6-7)10(2,3)12/h7-9,11-12H,4-6H2,1-3H3/t7-,8-,9-/m1/s1
InChIKey LMXFTMYMHGYJEI-IWSPIJDZSA-N
Mol Weight 172.27 g/mol
Molecular Formula C10H20O2
Exact Mass 172.14633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J9N2W83Kche
Name Menthol <8-hydroxy->
CAS Registry Number 3564-98-5
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 172.146329882 u
Formula C10H20O2
InChI InChI=1S/C10H20O2/c1-7-4-5-8(9(11)6-7)10(2,3)12/h7-9,11-12H,4-6H2,1-3H3/t7-,8-,9-/m1/s1
InChIKey LMXFTMYMHGYJEI-IWSPIJDZSA-N
Molecular Weight 172.268 g/mol
Number of Peaks 50
RI1 1343
RI2 1031
SMILES OC([C@]1([C@@](C[C@@](CC1)(C)[H])(O)[H])[H])(C)C
SPLASH splash10-0apo-9000000000-b4e7e358147ed47da32a
Sample Comments RI1: measured on SLB-5ms (Hydro) RI2: measured on SLB-5ms (FAMEs) RI3: measured on Supelcowax-10 (FAMEs) RI4: measured on Supelcowax-10 (FAEEs) RI5: measured on Equity-1 (Hydro)
Source of Spectrum Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy)
Synonyms Cyclohexanemethanol, 2-hydroxy-a,a,4-trimethyl-, (1R,2R,4R)-rel-
Wiley ID LM_FFNSC3_3372