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2-Amino-3-cyano-5[(-)-(1'R,2'S,5'R)-menthyloxycarbonyl]-6-methyl-4-(m-nitrophenyl)-4H-pyran
SpectraBase Compound ID EWSPHvO1uRR
InChI InChI=1S/C24H29N3O5/c1-13(2)18-9-8-14(3)10-20(18)32-24(28)21-15(4)31-23(26)19(12-25)22(21)16-6-5-7-17(11-16)27(29)30/h5-7,11,13-14,18,20,22H,8-10,26H2,1-4H3/t14-,18?,20?,22?/m1/s1
InChIKey DPRFLNXMVZXSOF-XOVWEWPFSA-N
Mol Weight 439.51 g/mol
Molecular Formula C24H29N3O5
Exact Mass 439.210721 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DnjBAVB0SXy
Name 2-Amino-3-cyano-5[(-)-(1'R,2'S,5'R)-menthyloxycarbonyl]-6-methyl-4-(m-nitrophenyl)-4H-pyran
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H29N3O5
InChI InChI=1S/C24H29N3O5/c1-13(2)18-9-8-14(3)10-20(18)32-24(28)21-15(4)31-23(26)19(12-25)22(21)16-6-5-7-17(11-16)27(29)30/h5-7,11,13-14,18,20,22H,8-10,26H2,1-4H3/t14-,18?,20?,22?/m1/s1
InChIKey DPRFLNXMVZXSOF-XOVWEWPFSA-N
Molecular Weight 439.512 g/mol
SMILES NC=1OC(=C(C(C1C#N)c1cc(N(=O)=O)ccc1)C(OC1C(CC[C@](C1)(C)[H])C(C)C)=O)C
SPLASH splash10-0uhm-9513000000-b414cda2a54c5e319011
Source of Spectrum F-50-3520-9
Synonyms (5R)-2-isopropyl-5-methylcyclohexyl 6-amino-5-cyano-2-methyl-4-(3-nitrophenyl)-4H-pyran-3-carboxylate
Wiley ID 1384430