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Alanine, N-[N-(1-adamantylcarbonyl)glycyl]-3-phenyl-, l-
SpectraBase Compound ID DC31MqaOAVj
InChI InChI=1S/C22H28N2O4/c25-19(24-18(20(26)27)9-14-4-2-1-3-5-14)13-23-21(28)22-10-15-6-16(11-22)8-17(7-15)12-22/h1-5,15-18H,6-13H2,(H,23,28)(H,24,25)(H,26,27)/t15-,16+,17-,18?,22-
InChIKey WCOUBQDBXLRVQJ-GGYKHCJJSA-N
Mol Weight 384.48 g/mol
Molecular Formula C22H28N2O4
Exact Mass 384.204907 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EqHOOm6VZVX
Name Alanine, N-[N-(1-adamantylcarbonyl)glycyl]-3-phenyl-, l-
CAS Registry Number 28415-48-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H28N2O4
InChI InChI=1S/C22H28N2O4/c25-19(24-18(20(26)27)9-14-4-2-1-3-5-14)13-23-21(28)22-10-15-6-16(11-22)8-17(7-15)12-22/h1-5,15-18H,6-13H2,(H,23,28)(H,24,25)(H,26,27)/t15-,16+,17-,18?,22-
InChIKey WCOUBQDBXLRVQJ-GGYKHCJJSA-N
Molecular Weight 384.476 g/mol
SMILES OC(C(Cc1ccccc1)NC(CNC(C12C[C@]3(C[C@](C[C@](C3)(C1)[H])(C2)[H])[H])=O)=O)=O
SPLASH splash10-000i-5921000000-3efb5013452c75aa6646
Source of Spectrum O-3-793-2
Synonyms N-([(1-Adamantylcarbonyl)amino]acetyl)phenylalanine 2-[2-(1-adamantylcarbonylamino)ethanoylamino]-3-phenyl-propanoic acid 2-[[2-(adamantane-1-carbonylamino)acetyl]amino]-3-phenyl-propanoic acid 2-[[2-(adamantane-1-carbonylamino)acetyl]amino]-3-phenyl-propionic acid 2-[[2-[[1-adamantyl(oxo)methyl]amino]-1-oxoethyl]amino]-3-phenylpropanoic acid
Wiley ID 55619