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(4S,6S)-4-benzoxy-6-methyl-dodecan-2-one
SpectraBase Compound ID EJmlQwnmZ0a
InChI InChI=1S/C20H32O2/c1-4-5-6-8-11-17(2)14-20(15-18(3)21)22-16-19-12-9-7-10-13-19/h7,9-10,12-13,17,20H,4-6,8,11,14-16H2,1-3H3/t17-,20-/m0/s1
InChIKey JLEPMHCLHSSFDW-PXNSSMCTSA-N
Mol Weight 304.5 g/mol
Molecular Formula C20H32O2
Exact Mass 304.24023 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9Nv1oHinCPK
Name (4S,6S)-4-benzoxy-6-methyl-dodecan-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H32O2
InChI InChI=1S/C20H32O2/c1-4-5-6-8-11-17(2)14-20(15-18(3)21)22-16-19-12-9-7-10-13-19/h7,9-10,12-13,17,20H,4-6,8,11,14-16H2,1-3H3/t17-,20-/m0/s1
InChIKey JLEPMHCLHSSFDW-PXNSSMCTSA-N
Molecular Weight 304.474 g/mol
SMILES C(C(=O)C)[C@@](OCc1ccccc1)(C[C@](CCCCCC)(C)[H])[H]
SPLASH splash10-0006-9500000000-8b572079ce776705cdd6
Source of Spectrum J-65-7901-25
Synonyms (4S,6S)-4-benzyloxy-6-methyl-dodecan-2-one (4S,6S)-6-methyl-4-phenylmethoxy-2-dodecanone (4S,6S)-6-methyl-4-phenylmethoxydodecan-2-one
Wiley ID 1533768