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(1R,2S,5R)-2-Isopropyl-5-methylcyclohexanol
SpectraBase Compound ID EmJ9ZPmckIb
InChI InChI=1S/C10H20O/c1-7(2)9-5-4-8(3)6-10(9)11/h7-11H,4-6H2,1-3H3/t8-,9+,10-/m1/s1
InChIKey NOOLISFMXDJSKH-KXUCPTDWSA-N
Mol Weight 156.27 g/mol
Molecular Formula C10H20O
Exact Mass 156.151415 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2oE44oShwKO
Name Menthol
CAS Registry Number 89-78-1
Classification Pharmaceutical drug, antiphlogistic, antipruriginosum, antiseptic, local anesthetic
Comments Spectrum verified by crosschecking against external libraries (two 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 156.151415263 u
Formula C10H20O
InChI InChI=1S/C10H20O/c1-7(2)9-5-4-8(3)6-10(9)11/h7-11H,4-6H2,1-3H3/t8-,9+,10-/m1/s1
InChIKey NOOLISFMXDJSKH-KXUCPTDWSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 156.269 g/mol
Nominal Mass 156 u
Quality 992
Retention Index 1166
SMILES O[C@]1([C@](C(C)C)(CC[C@](C1)(C)[H])[H])[H]
SPLASH splash10-05aj-9100000000-113f3c1b72750094b2ee
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Hexahydrothymol Menthakampfer Menthanol Peppermint Camphor Pfefferminz-kampfer p-Menthan-3-ol
Technique GC/MS
Wiley ID DD2024_029839