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2-Benzoyl-1,2,3,4-tetrahydro-3-isoquinolinecarboxylic acid

View entire compound with spectra: 1 MS (GC)

2-Benzoyl-1,2,3,4-tetrahydro-3-isoquinolinecarboxylic acid
SpectraBase Compound ID 8zafgNfOd7E
InChI InChI=1S/C17H15NO3/c19-16(12-6-2-1-3-7-12)18-11-14-9-5-4-8-13(14)10-15(18)17(20)21/h1-9,15H,10-11H2,(H,20,21)
InChIKey QBBPKILWLZTVIC-UHFFFAOYSA-N
Mol Weight 281.31 g/mol
Molecular Formula C17H15NO3
Exact Mass 281.105193 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5JUaxonu7OQ
Name 2-Benzoyl-1,2,3,4-tetrahydro-3-isoquinolinecarboxylic acid
Alternate Name(s) 2-(Phenylcarbonyl)-3,4-dihydro-1H-isoquinoline-3-carboxylic acid 2-Benzoyl-1,2,3,4-tetrahydro-isoquinoline-3-carboxylic acid 2-Benzoyl-3,4-dihydro-1H-isoquinoline-3-carboxylic acid
CAS Registry Number 93316-40-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H15NO3
InChI InChI=1S/C17H15NO3/c19-16(12-6-2-1-3-7-12)18-11-14-9-5-4-8-13(14)10-15(18)17(20)21/h1-9,15H,10-11H2,(H,20,21)
InChIKey QBBPKILWLZTVIC-UHFFFAOYSA-N
Molecular Weight 281.311 g/mol
SMILES OC(C1N(C(=O)c2ccccc2)Cc2c(cccc2)C1)=O
SPLASH splash10-0a6r-5920000000-6a4aeafbf7ed67d50b54
Wiley ID 1459674