SpectraBase Spectrum ID |
DJOobPxUIWK |
Name |
7,8-Diazatricyclo[4.3.0.02,5]non-8-ene-3,4-dicarboxylic acid, 7,9-diphenyl-, dimethyl ester, (1.alpha.,2.beta.,3.beta.,4.beta.,5.b eta.,6.alpha.)- |
CAS Registry Number |
100853-93-8 |
Comments |
Less than 3 mono-isotopic peaks |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C23H22N2O4 |
InChI |
InChI=1S/C23H22N2O4/c1-28-22(26)17-15-16(18(17)23(27)29-2)21-19(15)20(13-9-5-3-6-10-13)24-25(21)14-11-7-4-8-12-14/h3-12,15-19,21H,1-2H3/t15-,16+,17+,18-,19+,21+/m0/s1 |
InChIKey |
FWBNAZSKEQXECW-WKOMVXTHSA-N |
Molecular Weight |
390.439 g/mol |
SMILES |
C1(=NN([C@]2([C@@]1([C@]1([C@@]2([C@@]([C@@]1(C(=O)OC)[H])(C(=O)OC)[H])[H])[H])[H])[H])c1ccccc1)c1ccccc1 |
SPLASH |
splash10-00di-0090000000-69e438fe0799a2f6b5da |
Source of Spectrum |
K-118-4216-10 |
Synonyms |
2,3-Diaza-2,4-diphenyl-7,8-dimethoxycarbonyl-tricyclo[3.4.0.0(6,9)]nonane
dimethyl (1S,2R,3R,4S,5R,6R)-7,9-diphenyl-7,8-diazatricyclo[4.3.0.0(2,5)]non-8-ene-3,4-dicarboxylate |
Wiley ID |
1364932 |