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Benzenebutanol-.alpha.-13C, .beta.-methyl-, (R)-
SpectraBase Compound ID 6ubMLvgCGYi
InChI InChI=1S/C11H16O/c1-10(9-12)7-8-11-5-3-2-4-6-11/h2-6,10,12H,7-9H2,1H3/t10-/m1/s1/i9+1
InChIKey ITWNJDOHTYFDHG-AIKSKQLVSA-N
Mol Weight 165.24 g/mol
Molecular Formula C1013CH16O
Exact Mass 165.12347 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C0GA2jxib4a
Name Benzenebutanol-.alpha.-13C, .beta.-methyl-, (R)-
CAS Registry Number 65128-27-0
Comments Original formula: C10[13C]H16O
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H16O
InChI InChI=1S/C11H16O/c1-10(9-12)7-8-11-5-3-2-4-6-11/h2-6,10,12H,7-9H2,1H3/t10-/m1/s1/i9+1
InChIKey ITWNJDOHTYFDHG-AIKSKQLVSA-N
Molecular Weight 165.240 g/mol
SMILES [13CH2](O)[C@@](CCc1ccccc1)(C)[H]
SPLASH splash10-0fr6-8900000000-8487c2beb5952360e1a1
Source of Spectrum KC-1987-2433-0
Synonyms (2R)-[1-c(13)]-2-methyl-4-phenylbutanol
Wiley ID 1160931