Computer methods in analytical mass spectrometry. Identification of an unknown compound in a catalog

LR Crawford, JD Morrison - Analytical chemistry, 1968 - ACS Publications
The combination of a gas-liquid chromatograph and mass spectrometer is capableof
producing a great amount of information about a chemical compound's structure. Methods of …

Computer methods in analytical mass spectrometry. Empirical identification of molecular class

LR Crawford, JD Morrison - Analytical Chemistry, 1968 - ACS Publications
CONCLUSION If a catalog of complete mass spectra can be stored, the problem of retrieval
and identification of a given spectrum is almost a trivial one. Even when using the ASTM …

Computer-operated mass spectrometer system

WE Reynolds, VA Bacon, JC Bridges… - Analytical …, 1970 - ACS Publications
An integer resolution mass spectrometer-computer system has been developed in which the
computer controls the “scan” of a mass spectrometer. In this system, the computer queries …

[引用][C] Computer applications in mass spectral interpretation: A recent review

DP Martinsen, BH Song - Mass Spectrometry Reviews, 1985 - Wiley Online Library
Since their introduction into the analytical chemistry laboratory in the late 1960s and early
1970s. computers have become an integral part of modern mass spectrometers and are …

Computer methods in analytical mass spectrometry. Development of programs for analysis of low-resolution mass spectra

LR Crawford, JD Morrison - Analytical Chemistry, 1971 - ACS Publications
A computer program which analyzes low resolution mass spectra of organic compounds of
molecular weight less than 200 is described. The program operates ab initio, that is, it does …

Mass spectrometric analysis. Spectral data file utilizing machine filing and manual searching

FW McLafferty, RS Gohike - Analytical Chemistry, 1959 - ACS Publications
A new filing system for mass spectra utilizes the unique advantages of the mass
spectrometer in mixture identification. No machine searching of this file is necessary …

Automatic reduction of high-resolution mass spectral data. Computer techniques for improved mass-measuring accuracy and resolution

R Venkataraghavan, FW McLafferty… - Analytical …, 1967 - ACS Publications
An automatic system makes possible the rapid and ac-curate preparation of element maps
from high-resolution mass spectra recorded on photoplates. By meas-uring transmittance …

Mass spectral data processing. Identification of aliphatic hydrocarbons

B Pettersson, R Ryhage - Analytical Chemistry, 1967 - ACS Publications
A computer method is described for identification of aliphatic saturated normal and
monomethyl substituted hydrocarbons from C6 to C·». The procedure involves a rectangular …

[图书][B] Mass spectrometry: instrumentation, interpretation, and applications

A Kraj, DM Desiderio, NM Nibbering - 2008 - books.google.com
With contributions from noted experts from Europe and North America, Mass Spectrometry
Instrumentation, Interpretation, and Applications serves as a forum to introduce students to …

The mass spectrometer as a substance-selective detector in chromatography

WL Budde, JW Eichelberger - Journal of Chromatography A, 1977 - Elsevier
The computerized mass spectrometer has several modes of data acquisition when applied
as a detector in chromatographis systems. These and several modes of data reduction are …