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ADB-IATA
SpectraBase Compound ID LwKHig3Di1G
InChI InChI=1S/C16H21N3O2/c1-16(2,3)14(15(17)21)19-13(20)8-10-9-18-12-7-5-4-6-11(10)12/h4-7,9,14,18H,8H2,1-3H3,(H2,17,21)(H,19,20)/t14-/m1/s1
InChIKey WUWCLBKDNAZHPN-CQSZACIVSA-N
Mol Weight 287.36 g/mol
Molecular Formula C16H21N3O2
Exact Mass 287.163377 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B1s0qg9gEaG
Name ADB-IATA
Catalog Number 37053
Lot Number 661712
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 287.163376926 u
Formula C16H21N3O2
InChI InChI=1S/C16H21N3O2/c1-16(2,3)14(15(17)21)19-13(20)8-10-9-18-12-7-5-4-6-11(10)12/h4-7,9,14,18H,8H2,1-3H3,(H2,17,21)(H,19,20)/t14-/m1/s1
InChIKey WUWCLBKDNAZHPN-CQSZACIVSA-N
Molecular Weight 287.363 g/mol
Purity >=98%
Quality 1000
SMILES N1C2=C(C(CC(N[C@](C(N)=O)(C(C)(C)C)[H])=O)=C1)C=CC=C2
SPLASH splash10-001i-3910000000-65c54f3a00e323a6b164
Source of Spectrum CAY-2024-2314-0
Synonyms ADB-IACA (S)-2-(2-(1H-indol-3-yl)acetamido)-3,3-dimethylbutanamide (2S)-2-[2-(1H-indol-3-yl)acetamido]-3,3-dimethylbutanamide
Wiley ID 1890495