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Ethyl (2R*,3R*,4S*)-4-(4-methoxyphenyl)-3-methyl-3,4-dihydro-2H-pyrimido[2,1-b][1,3]benzpxazole-2-carboxylate
SpectraBase Compound ID 94pwIET6nzU
InChI InChI=1S/C21H22N2O4/c1-4-26-20(24)18-13(2)19(14-9-11-15(25-3)12-10-14)23-16-7-5-6-8-17(16)27-21(23)22-18/h5-13,18-19H,4H2,1-3H3/t13-,18-,19+/m1/s1
InChIKey VKKUVHWAQHKVFR-ZNOIYHFQSA-N
Mol Weight 366.42 g/mol
Molecular Formula C21H22N2O4
Exact Mass 366.157957 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KPm6hZZZrtF
Name Ethyl (2R*,3R*,4S*)-4-(4-methoxyphenyl)-3-methyl-3,4-dihydro-2H-pyrimido[2,1-b][1,3]benzpxazole-2-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H22N2O4
InChI InChI=1S/C21H22N2O4/c1-4-26-20(24)18-13(2)19(14-9-11-15(25-3)12-10-14)23-16-7-5-6-8-17(16)27-21(23)22-18/h5-13,18-19H,4H2,1-3H3/t13-,18-,19+/m1/s1
InChIKey VKKUVHWAQHKVFR-ZNOIYHFQSA-N
Molecular Weight 366.417 g/mol
SMILES C=12N([C@](c3ccc(cc3)OC)([C@@]([C@@](N1)(C(=O)OCC)[H])(C)[H])[H])c1ccccc1O2
SPLASH splash10-0006-0391000000-cbf635338bb90f87c25e
Source of Spectrum KC-0-3394-9d
Wiley ID 826687