APPLICATIONS OF ARTIFICIAL-INTELLIGENCE FOR CHEMICAL INFERENCE .34. COMPUTER-ASSISTED STRUCTURAL INTERPRETATION OF C-13 SPECTRAL DATA

被引:41
作者
GRAY, NAB [1 ]
CRANDELL, CW [1 ]
NOURSE, JG [1 ]
SMITH, DH [1 ]
DAGEFORDE, ML [1 ]
DJERASSI, C [1 ]
机构
[1] STANFORD UNIV, DEPT CHEM, STANFORD, CA 94305 USA
关键词
D O I
10.1021/jo00317a012
中图分类号
O62 [有机化学];
学科分类号
070303 ; 081704 ;
摘要
引用
收藏
页码:703 / 715
页数:13
相关论文
共 53 条
[11]   MODEL-BASED APPROACH TO TELETYPE PRINTING OF CHEMICAL STRUCTURES [J].
CARHART, RE .
JOURNAL OF CHEMICAL INFORMATION AND COMPUTER SCIENCES, 1976, 16 (02) :82-88
[12]  
CARHART RE, J ORG CHEM
[13]   12-EPI-SCALARIN AND 12-EPI-DEOXOSCALARIN, SESTERTERPENES FROM SPONGE SPONGIA-NITENS [J].
CIMINO, G ;
DESTEFANO, S ;
MINALE, L ;
TRIVELLONE, E .
JOURNAL OF THE CHEMICAL SOCIETY-PERKIN TRANSACTIONS 1, 1977, (13) :1587-1593
[14]   MINICOMPUTER PROGRAM BASED ON ADDITIVITY RULES FOR ESTIMATION OF C-13-NMR CHEMICAL-SHIFTS [J].
CLERC, JT ;
SOMMERAUER, H .
ANALYTICA CHIMICA ACTA, 1977, 95 (1-2) :33-40
[15]   C-13 CHEMICAL-SHIFTS OF SOME MODEL CARBOXYLIC-ACIDS AND ESTERS [J].
COUPERUS, PA ;
CLAGUE, ADH ;
VANDONGEN, JPCM .
ORGANIC MAGNETIC RESONANCE, 1978, 11 (12) :590-597
[16]  
CRANDELL CW, UNPUB
[17]   C-13 NUCLEAR MAGNETIC-RESONANCE SPECTRAL DATA-BASE AND SEARCH SYSTEM [J].
DALRYMPLE, DL ;
WILKINS, CL ;
MILNE, GWA ;
HELLER, SR .
ORGANIC MAGNETIC RESONANCE, 1978, 11 (11) :535-540
[18]   C-13 NMR-STUDY OF EPOXIDES IN THE DITERPENE SERIES [J].
DELMOND, B ;
PAPILLAUD, B ;
VALADE, J ;
PETRAUD, M ;
BARBE, B .
ORGANIC MAGNETIC RESONANCE, 1979, 12 (04) :209-211
[19]  
DJERASSI C, 1974, 13C NMR SPECTROSCOPY
[20]  
Dubois J. E., 1979, Analytica Chimica Acta, Computer Techniques and Optimization, V112, P245, DOI 10.1016/S0003-2670(01)83553-4