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(R*,R*)-Dimethyl 2-[2-(3,4-diazatricyclo[5.2.1.0(2,6)]dec-4-en-3-yl)-2-phenylethyl]malonate
SpectraBase Compound ID 62sQatSBIHR
InChI InChI=1S/C21H26N2O4/c1-26-20(24)16(21(25)27-2)11-18(13-6-4-3-5-7-13)23-19-15-9-8-14(10-15)17(19)12-22-23/h3-7,12,14-19H,8-11H2,1-2H3/t14-,15+,17-,18-,19?/m1/s1
InChIKey STWGBIGDONKIJE-MBGYLJKNSA-N
Mol Weight 370.45 g/mol
Molecular Formula C21H26N2O4
Exact Mass 370.189257 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2mehAlqwOFU
Name (R*,R*)-Dimethyl 2-[2-(3,4-diazatricyclo[5.2.1.0(2,6)]dec-4-en-3-yl)-2-phenylethyl]malonate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H26N2O4
InChI InChI=1S/C21H26N2O4/c1-26-20(24)16(21(25)27-2)11-18(13-6-4-3-5-7-13)23-19-15-9-8-14(10-15)17(19)12-22-23/h3-7,12,14-19H,8-11H2,1-2H3/t14-,15+,17-,18-,19?/m1/s1
InChIKey STWGBIGDONKIJE-MBGYLJKNSA-N
Molecular Weight 370.449 g/mol
SMILES C1=NN(C2[C@]1([C@]1(C[C@@]2(CC1)[H])[H])[H])[C@](CC(C(=O)OC)C(=O)OC)(c1ccccc1)[H]
SPLASH splash10-004i-1390000000-5c6b30af6c693ae2e504
Source of Spectrum F-66-9156-4e'
Wiley ID 1685036