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Benzyl 1-(tert-Butylperoxy)-3,4-dihydroisoquinoline-2(1H)-carboxylate
SpectraBase Compound ID ASG01KVfBrI
InChI InChI=1S/C21H25NO4/c1-21(2,3)26-25-19-18-12-8-7-11-17(18)13-14-22(19)20(23)24-15-16-9-5-4-6-10-16/h4-12,19H,13-15H2,1-3H3
InChIKey LQORQIZJLGTTPV-UHFFFAOYSA-N
Mol Weight 355.43 g/mol
Molecular Formula C21H25NO4
Exact Mass 355.178358 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C401d2O5m4g
Name Benzyl 1-(tert-Butylperoxy)-3,4-dihydroisoquinoline-2(1H)-carboxylate
Alternate Name(s) 1-Tert-butyldioxy-3,4-dihydro-1H-isoquinoline-2-carboxylic acid (phenylmethyl) ester Benzyl 1-tert-butylperoxy-3,4-dihydro-1H-isoquinoline-2-carboxylate (phenylmethyl) 1-tert-butylperoxy-3,4-dihydro-1H-isoquinoline-2-carboxylate
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Formula C21H25NO4
InChI InChI=1S/C21H25NO4/c1-21(2,3)26-25-19-18-12-8-7-11-17(18)13-14-22(19)20(23)24-15-16-9-5-4-6-10-16/h4-12,19H,13-15H2,1-3H3
InChIKey LQORQIZJLGTTPV-UHFFFAOYSA-N
Molecular Weight 355.434 g/mol
SMILES C1(N(CCc2ccccc12)C(OCc1ccccc1)=O)OOC(C)(C)C
SPLASH splash10-0006-9060000000-bb4167ca4f02ffee9d02
Source of Spectrum U1-2013-670-2a
Wiley ID 1735783