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2,2-Dimethylpropionic acid, [2-(2,2-dimethylpropionyl)-1,2,3,4-tetrahydroisoquinolin-1-yl]phenylmethyl ester
SpectraBase Compound ID 7ek9VRtiq77
InChI InChI=1S/C26H33NO3/c1-25(2,3)23(28)27-17-16-18-12-10-11-15-20(18)21(27)22(19-13-8-7-9-14-19)30-24(29)26(4,5)6/h7-15,21-22H,16-17H2,1-6H3
InChIKey YLYISEHBXFLJSA-UHFFFAOYSA-N
Mol Weight 407.6 g/mol
Molecular Formula C26H33NO3
Exact Mass 407.246044 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B2TRis23Ruy
Name 2,2-Dimethylpropionic acid, [2-(2,2-dimethylpropionyl)-1,2,3,4-tetrahydroisoquinolin-1-yl]phenylmethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H33NO3
InChI InChI=1S/C26H33NO3/c1-25(2,3)23(28)27-17-16-18-12-10-11-15-20(18)21(27)22(19-13-8-7-9-14-19)30-24(29)26(4,5)6/h7-15,21-22H,16-17H2,1-6H3
InChIKey YLYISEHBXFLJSA-UHFFFAOYSA-N
Molecular Weight 407.554 g/mol
SMILES CC(C(OC(C1c2ccccc2CCN1C(=O)C(C)(C)C)c1ccccc1)=O)(C)C
SPLASH splash10-066r-9480000000-fc327cdf5c66a61f853d
Synonyms [2-(2,2-Dimethylpropanoyl)-1,2,3,4-tetrahydro-1-isoquinolinyl](phenyl)methyl pivalate 2,2-Dimethylpropanoic acid [[2-(2,2-dimethyl-1-oxopropyl)-3,4-dihydro-1H-isoquinolin-1-yl]-phenylmethyl] ester [[2-(2,2-dimethylpropanoyl)-3,4-dihydro-1H-isoquinolin-1-yl]-phenylmethyl] 2,2-dimethylpropanoate [[2-(2,2-dimethylpropanoyl)-3,4-dihydro-1H-isoquinolin-1-yl]-phenyl-methyl] 2,2-dimethylpropanoate
Wiley ID 1480013