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(S)-N-[2'-(Hydroxymethyl)phenyl]-N-methyl-L-valine-Benzyl Ester
SpectraBase Compound ID HRC8a47PRKV
InChI InChI=1S/C20H25NO3/c1-15(2)19(20(23)24-14-16-9-5-4-6-10-16)21(3)18-12-8-7-11-17(18)13-22/h4-12,15,19,22H,13-14H2,1-3H3/t19-/m0/s1
InChIKey KMFXKOMHLFMDBY-IBGZPJMESA-N
Mol Weight 327.42 g/mol
Molecular Formula C20H25NO3
Exact Mass 327.183444 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IjA4tIgWo4B
Name (S)-N-[2'-(Hydroxymethyl)phenyl]-N-methyl-L-valine-Benzyl Ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H25NO3
InChI InChI=1S/C20H25NO3/c1-15(2)19(20(23)24-14-16-9-5-4-6-10-16)21(3)18-12-8-7-11-17(18)13-22/h4-12,15,19,22H,13-14H2,1-3H3/t19-/m0/s1
InChIKey KMFXKOMHLFMDBY-IBGZPJMESA-N
Molecular Weight 327.424 g/mol
SMILES OCc1c(N([C@](C(OCc2ccccc2)=O)(C(C)C)[H])C)cccc1
SPLASH splash10-004i-8519000000-d0977d7ac47bb6e65bbb
Source of Spectrum C-120-12466-33
Wiley ID 1699944