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Methyl 1-(benzylamino)-3-[(methoxycarbonyl)methyl]-2,3,4,5,6,7-hexahydro-1H-2-indenecarboxylate
SpectraBase Compound ID 2sQqIZJt3IG
InChI InChI=1S/C21H27NO4/c1-25-18(23)12-17-15-10-6-7-11-16(15)20(19(17)21(24)26-2)22-13-14-8-4-3-5-9-14/h3-5,8-9,17,19-20,22H,6-7,10-13H2,1-2H3
InChIKey IJXSPCAPDXEQQI-UHFFFAOYSA-N
Mol Weight 357.45 g/mol
Molecular Formula C21H27NO4
Exact Mass 357.194008 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J2vyk5dyNRX
Name Methyl 1-(benzylamino)-3-[(methoxycarbonyl)methyl]-2,3,4,5,6,7-hexahydro-1H-2-indenecarboxylate
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Formula C21H27NO4
InChI InChI=1S/C21H27NO4/c1-25-18(23)12-17-15-10-6-7-11-16(15)20(19(17)21(24)26-2)22-13-14-8-4-3-5-9-14/h3-5,8-9,17,19-20,22H,6-7,10-13H2,1-2H3
InChIKey IJXSPCAPDXEQQI-UHFFFAOYSA-N
Molecular Weight 357.450 g/mol
SMILES N(C1C(C(C=2CCCCC12)CC(=O)OC)C(=O)OC)Cc1ccccc1
SPLASH splash10-0006-9720000000-66f9a1d6dee588632a37
Source of Spectrum U-1996-907-12a
Wiley ID 768589