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Methyl 1-[[(2,2-dimethylpropanoyl)oxy](phenyl)methyl]-1,2,3,4-tetrahydro-3-isoquinolinecarboxylate
SpectraBase Compound ID 7Z7JRVcIPUk
InChI InChI=1S/C23H27NO4/c1-23(2,3)22(26)28-20(15-10-6-5-7-11-15)19-17-13-9-8-12-16(17)14-18(24-19)21(25)27-4/h5-13,18-20,24H,14H2,1-4H3
InChIKey RJGPYACAIPHQFU-UHFFFAOYSA-N
Mol Weight 381.47 g/mol
Molecular Formula C23H27NO4
Exact Mass 381.194008 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KlOHIaaJXVK
Name Methyl 1-[[(2,2-dimethylpropanoyl)oxy](phenyl)methyl]-1,2,3,4-tetrahydro-3-isoquinolinecarboxylate
Alternate Name(s) 1-[(2,2-dimethyl-1-oxopropoxy)-phenylmethyl]-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid methyl ester 1-[phenyl(pivaloyloxy)methyl]-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid methyl ester 3-Isoquinolinecarboxylic acid, 1-[(2,2-dimethyl-1-oxopropoxy)phenylmethyl]-1,2,3,4-tetrahydro-, methyl ester Methyl 1-[2,2-dimethylpropanoyloxy(phenyl)methyl]-1,2,3,4-tetrahydroisoquinoline-3-carboxylate
CAS Registry Number 116174-85-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H27NO4
InChI InChI=1S/C23H27NO4/c1-23(2,3)22(26)28-20(15-10-6-5-7-11-15)19-17-13-9-8-12-16(17)14-18(24-19)21(25)27-4/h5-13,18-20,24H,14H2,1-4H3
InChIKey RJGPYACAIPHQFU-UHFFFAOYSA-N
Molecular Weight 381.472 g/mol
SMILES N1C(c2ccccc2CC1C(=O)OC)C(OC(=O)C(C)(C)C)c1ccccc1
SPLASH splash10-0006-2900000000-ea08a7eededb40004c04
Wiley ID 1485515