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2-[N-(2',2'-Dimethylpropyl)amino]-3-indolylpropanoic acid
SpectraBase Compound ID JrQXnuM3Ghp
InChI InChI=1S/C16H22N2O2/c1-16(2,3)10-17-15-12(8-9-14(19)20)11-6-4-5-7-13(11)18-15/h4-7,17-18H,8-10H2,1-3H3,(H,19,20)
InChIKey LBSJQZKLCJJYRB-UHFFFAOYSA-N
Mol Weight 274.36 g/mol
Molecular Formula C16H22N2O2
Exact Mass 274.168128 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DkREWOnZ1P1
Name 2-[N-(2',2'-Dimethylpropyl)amino]-3-indolylpropanoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H22N2O2
InChI InChI=1S/C16H22N2O2/c1-16(2,3)10-17-15-12(8-9-14(19)20)11-6-4-5-7-13(11)18-15/h4-7,17-18H,8-10H2,1-3H3,(H,19,20)
InChIKey LBSJQZKLCJJYRB-UHFFFAOYSA-N
Molecular Weight 274.364 g/mol
SMILES [nH]1c2ccccc2c(c1NCC(C)(C)C)CCC(=O)O
SPLASH splash10-001i-0900000000-647f4dee3b480cb61d5e
Source of Spectrum I-80-783-6
Synonyms 3-[2-(neopentylamino)-1H-indol-3-yl]propanoic acid
Wiley ID 1517209