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1-[(1R,3S)-1-methyl-3-phenyl-butyl]naphthalene
SpectraBase Compound ID 20WawLdLjpC
InChI InChI=1S/C21H22/c1-16(18-9-4-3-5-10-18)15-17(2)20-14-8-12-19-11-6-7-13-21(19)20/h3-14,16-17H,15H2,1-2H3/t16-,17+/m0/s1
InChIKey PYLFBRZNYWBGMG-DLBZAZTESA-N
Mol Weight 274.41 g/mol
Molecular Formula C21H22
Exact Mass 274.172151 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E0sY5UDRG8a
Name 1-[(1R,3S)-1-methyl-3-phenyl-butyl]naphthalene
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H22
InChI InChI=1S/C21H22/c1-16(18-9-4-3-5-10-18)15-17(2)20-14-8-12-19-11-6-7-13-21(19)20/h3-14,16-17H,15H2,1-2H3/t16-,17+/m0/s1
InChIKey PYLFBRZNYWBGMG-DLBZAZTESA-N
Instrument Name FINNIGAN MAT 95Q
Ionization Type EI
Literature Reference DOI 10.1002/anie.201910397
Molecular Weight 274.407 g/mol
Reported Formula C21H22
SMILES c1c(cccc1)[C@@](C)(C[C@@](C)(c1cccc2c1cccc2)[H])[H]
SPLASH splash10-0pb9-0900000000-213c17b7feda0a9fb2dd
Sample Comments dr = 94:6
Source of Spectrum ACI-59-SM36-syn-6j
Wiley ID 1856773