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(2S,3S)-3-methylheptan-2-ol
SpectraBase Compound ID 9vzkDFgNjZ0
InChI InChI=1S/C8H18O/c1-4-5-6-7(2)8(3)9/h7-9H,4-6H2,1-3H3/t7-,8-/m0/s1
InChIKey SZERMVMTUUAYML-YUMQZZPRSA-N
Mol Weight 130.23 g/mol
Molecular Formula C8H18O
Exact Mass 130.135765 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F4cMVlKcn5k
Name (2S,3S)-3-methylheptan-2-ol
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 130.135765199 u
Formula C8H18O
InChI InChI=1S/C8H18O/c1-4-5-6-7(2)8(3)9/h7-9H,4-6H2,1-3H3/t7-,8-/m0/s1
InChIKey SZERMVMTUUAYML-YUMQZZPRSA-N
Instrument Name Finnigan MAT 95Q or Finnigan MAT 90 or JEOL JMS-700
Ionization Type EI
Literature Reference DOI 10.1002/chem.201601911
Molecular Weight 130.231 g/mol
Quality 200
Reported Formula C8H18O
SMILES O[C@]([C@](CCCC)(C)[H])(C)[H]
SPLASH splash10-000t-9000000000-23b41c018816d31e8ecc
Sample Comments dr = 99:1
Source of Spectrum QE-22-SM7-anti-s2 (DOI: 10.1002/chem.201601911)
Wiley ID 1903517