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[1-(13)C]-4-(benzyloxy)-2-butanol
SpectraBase Compound ID BCUSMQaJ9G7
InChI InChI=1S/C11H16O2/c1-10(12)7-8-13-9-11-5-3-2-4-6-11/h2-6,10,12H,7-9H2,1H3/i1+1
InChIKey PPVYBGKNKMMISH-OUBTZVSYSA-N
Mol Weight 181.24 g/mol
Molecular Formula C1013CH16O2
Exact Mass 181.118385 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9ClehnUas8D
Name [1-(13)C]-4-(benzyloxy)-2-butanol
Alternate Name(s) 4-(benzyloxy)butan-2-ol-1-¹³C
Comments Original formula: C10[13C]H16O2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H16O2
InChI InChI=1S/C11H16O2/c1-10(12)7-8-13-9-11-5-3-2-4-6-11/h2-6,10,12H,7-9H2,1H3/i1+1
InChIKey PPVYBGKNKMMISH-OUBTZVSYSA-N
Literature Reference DOI 10.1002/cbic.201402298
Molecular Weight 181.239 g/mol
SMILES [13CH3]C(CCOCc1ccccc1)O
SPLASH splash10-054o-9300000000-195d9c22e37be4480c73
Source of Spectrum CBC-15-2379/SM17-25
Wiley ID 1786836