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2-(2,2-dimethyl-1-oxopropyl)-3,4-dihydro-1H-isoquinoline-3-carboxylic acid
SpectraBase Compound ID JvnraroUQHR
InChI InChI=1S/C15H19NO3/c1-15(2,3)14(19)16-9-11-7-5-4-6-10(11)8-12(16)13(17)18/h4-7,12H,8-9H2,1-3H3,(H,17,18)
InChIKey BCVSZTDHBXSNGP-UHFFFAOYSA-N
Mol Weight 261.32 g/mol
Molecular Formula C15H19NO3
Exact Mass 261.136493 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Gb7CzNCIkQ5
Name 2-(2,2-dimethyl-1-oxopropyl)-3,4-dihydro-1H-isoquinoline-3-carboxylic acid
Comments Less than 3 mono-isotopic peaks
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Formula C15H19NO3
InChI InChI=1S/C15H19NO3/c1-15(2,3)14(19)16-9-11-7-5-4-6-10(11)8-12(16)13(17)18/h4-7,12H,8-9H2,1-3H3,(H,17,18)
InChIKey BCVSZTDHBXSNGP-UHFFFAOYSA-N
Molecular Weight 261.321 g/mol
SMILES OC(C1N(C(C(C)(C)C)=O)Cc2c(cccc2)C1)=O
SPLASH splash10-004i-0920000000-a30fbf6b18c16da5250e
Source of Spectrum E1-45-1251-13
Synonyms 2-(2,2-Dimethylpropionyl)-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid 2-(2,2-Dimethylpropanoyl)-1,2,3,4-tetrahydro-3-isoquinolinecarboxylic acid 2-(2,2-dimethylpropanoyl)-3,4-dihydro-1H-isoquinoline-3-carboxylic acid 2-pivaloyl-3,4-dihydro-1H-isoquinoline-3-carboxylic acid
Wiley ID 1553989