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D-Alloisoleucine, N-acetyl-
SpectraBase Compound ID JAFjAZV8oc4
InChI InChI=1S/C8H15NO3/c1-4-5(2)7(8(11)12)9-6(3)10/h5,7H,4H2,1-3H3,(H,9,10)(H,11,12)
InChIKey JDTWZSUNGHMMJM-UHFFFAOYSA-N
Mol Weight 173.21 g/mol
Molecular Formula C8H15NO3
Exact Mass 173.105193 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5BSQDbjYvzR
Name D-Alloisoleucine, N-acetyl-
CAS Registry Number 54831-20-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H15NO3
InChI InChI=1S/C8H15NO3/c1-4-5(2)7(8(11)12)9-6(3)10/h5,7H,4H2,1-3H3,(H,9,10)(H,11,12)
InChIKey JDTWZSUNGHMMJM-UHFFFAOYSA-N
Molecular Weight 173.212 g/mol
SMILES N(C(C(=O)O)C(C)CC)C(C)=O
SPLASH splash10-052p-9200000000-559bafdb2b0b42627e51
Source of Spectrum NP-17-5549-0
Synonyms N-Acetylisoleucine 2-Acetamido-3-methyl-pentanoic acid 2-Acetamido-3-methyl-valeric acid DL-Alloisoleucine, N-acetyl- Acetyl-d-alloisoleucine L-Isoleucine, N-acetyl- Isoleucine, N-acetyl-, DL- Isoleucine, N-acetyl-, L- N-Acetyl-(D-allo)-isoleucine N-Acetyl-DL-alloisoleucine N-acetyl-DL-isoleucine N-Acetyl-L-isoleucine EINECS 221-364-9
Wiley ID 1101412