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(3S,4S)-3,4-dimethyl-5-phenyl-pentan-1-ol
SpectraBase Compound ID 6qd1XeuAeTC
InChI InChI=1S/C13H20O/c1-11(8-9-14)12(2)10-13-6-4-3-5-7-13/h3-7,11-12,14H,8-10H2,1-2H3/t11-,12-/m0/s1
InChIKey BXENXFVUYONCOT-RYUDHWBXSA-N
Mol Weight 192.3 g/mol
Molecular Formula C13H20O
Exact Mass 192.151415 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AgmDUSGMjqD
Name (3S,4S)-3,4-dimethyl-5-phenyl-pentan-1-ol
Appearance Colorless oil
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Formula C13H20O
InChI InChI=1S/C13H20O/c1-11(8-9-14)12(2)10-13-6-4-3-5-7-13/h3-7,11-12,14H,8-10H2,1-2H3/t11-,12-/m0/s1
InChIKey BXENXFVUYONCOT-RYUDHWBXSA-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 192.302 g/mol
Quality 271
Reported Formula C13H20O
SMILES OCC[C@@]([C@](CC=1C=CC=CC1)(C)[H])(C)[H]
SPLASH splash10-053u-9200000000-2256c27aa8f0918b981e
Sample Comments dr = 26:74
Source of Spectrum QE-22-SM49-syn-6b (DOI: 10.1002/chem.201601911)
Wiley ID 1903540