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2-Amino-3-cyano-5[(-)-(1'S,2'R,4'S)bornyloxycarbonyl]-6-methyl-4-(m-nitrophenyl)-4H-pyran

View entire compound with spectra: 1 MS (GC)

2-Amino-3-cyano-5[(-)-(1'S,2'R,4'S)bornyloxycarbonyl]-6-methyl-4-(m-nitrophenyl)-4H-pyran
SpectraBase Compound ID Bb315nK3V0Y
InChI InChI=1S/C24H27N3O5/c1-13-19(22(28)32-18-11-15-8-9-24(18,4)23(15,2)3)20(17(12-25)21(26)31-13)14-6-5-7-16(10-14)27(29)30/h5-7,10,15,18,20H,8-9,11,26H2,1-4H3/t15-,18-,20?,24+/m0/s1
InChIKey PWRROEDBBFQGKM-USQGOAITSA-N
Mol Weight 437.5 g/mol
Molecular Formula C24H27N3O5
Exact Mass 437.195071 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8FU5dim27JZ
Name 2-Amino-3-cyano-5[(-)-(1'S,2'R,4'S)bornyloxycarbonyl]-6-methyl-4-(m-nitrophenyl)-4H-pyran
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H27N3O5
InChI InChI=1S/C24H27N3O5/c1-13-19(22(28)32-18-11-15-8-9-24(18,4)23(15,2)3)20(17(12-25)21(26)31-13)14-6-5-7-16(10-14)27(29)30/h5-7,10,15,18,20H,8-9,11,26H2,1-4H3/t15-,18-,20?,24+/m0/s1
InChIKey PWRROEDBBFQGKM-USQGOAITSA-N
Molecular Weight 437.496 g/mol
SMILES NC=1OC(=C(C(C1C#N)c1cc(N(=O)=O)ccc1)C(O[C@@]1([C@@]2(C(C)(C)[C@](C1)(CC2)[H])C)[H])=O)C
SPLASH splash10-0fsd-9502000000-4a462b6ff70998e5ccbf
Source of Spectrum F-50-3521-9
Synonyms (1S,2R,4S)-1,7,7-trimethylbicyclo[2.2.1]hept-2-yl 6-amino-5-cyano-2-methyl-4-(3-nitrophenyl)-4H-pyran-3-carboxylate
Wiley ID 1383813