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(2S)-3-(2,4-dimethoxyphenyl)-2-(9H-fluoren-9-ylmethoxycarbonylamino)propionic acid
SpectraBase Compound ID ENHu6q7HIq1
InChI InChI=1S/C26H25NO6/c1-31-17-12-11-16(24(14-17)32-2)13-23(25(28)29)27-26(30)33-15-22-20-9-5-3-7-18(20)19-8-4-6-10-21(19)22/h3-12,14,22-23H,13,15H2,1-2H3,(H,27,30)(H,28,29)/t23-/m0/s1
InChIKey NSEYNINRRAPYSC-QHCPKHFHSA-N
Mol Weight 447.49 g/mol
Molecular Formula C26H25NO6
Exact Mass 447.168188 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID nf0XJjlCCK
Name (2S)-3-(2,4-dimethoxyphenyl)-2-(9H-fluoren-9-ylmethoxycarbonylamino)propionic acid
Alternate Name(s) (2S)-3-(2,4-dimethoxyphenyl)-2-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]propanoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H25NO6
InChI InChI=1S/C26H25NO6/c1-31-17-12-11-16(24(14-17)32-2)13-23(25(28)29)27-26(30)33-15-22-20-9-5-3-7-18(20)19-8-4-6-10-21(19)22/h3-12,14,22-23H,13,15H2,1-2H3,(H,27,30)(H,28,29)/t23-/m0/s1
InChIKey NSEYNINRRAPYSC-QHCPKHFHSA-N
Molecular Weight 447.487 g/mol
SMILES N([C@](C(=O)O)(Cc1c(cc(cc1)OC)OC)[H])C(OCC1c2c(cccc2)-c2c1cccc2)=O
SPLASH splash10-0udi-0900000000-4388277553583f510bdb
Source of Spectrum K-2001-1882-11
Wiley ID 1579415