| SpectraBase Spectrum ID |
EvCSAmRIPev |
| Name |
2-Amino-3-[(-)-(1'S,2'R,4'S)-bornyloxycarbonyl]-5-cyano-4,6-diphenyl-4H-pyran |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
454.225642831 u |
| Formula |
C29H30N2O3 |
| InChI |
InChI=1S/C29H30N2O3/c1-28(2)20-14-15-29(28,3)22(16-20)33-27(32)24-23(18-10-6-4-7-11-18)21(17-30)25(34-26(24)31)19-12-8-5-9-13-19/h4-13,20,22-23H,14-16,31H2,1-3H3/t20-,22+,23?,29+/m0/s1 |
| InChIKey |
GNLBKOBPXSSNSR-VJZKFCLVSA-N |
| Molecular Weight |
454.570 g/mol |
| SMILES |
C1(=C(OC(=C(C1C=1C=CC=CC1)C#N)C1=CC=CC=C1)N)C(O[C@]1([C@@]2(C(C)(C)[C@](C1)(CC2)[H])C)[H])=O |
![2-Amino-3-[(-)-(1'S,2'R,4'S)-bornyloxycarbonyl]-5-cyano-4,6-diphenyl-4H-pyran](/api/spectrum/EvCSAmRIPev/structure.png?h=300&w=458 "2-Amino-3-[(-)-(1'S,2'R,4'S)-bornyloxycarbonyl]-5-cyano-4,6-diphenyl-4H-pyran")
