Substructure Search
mass calculator
user manual
Substructure
Query1
AND
Query2
Comparison of pi-electron for each atom
number in query = number in target
number in query <= number in target
none
* Double and triple bound is translated to pi-electrons of the bonded atoms.
Copyright © 2008 K. Tanaka and S. Kanaya, NAIST, Japan
Instrument Type
ESI
LC-ESI-ITFT
LC-ESI-QQ
LC-ESI-TOF
Others
LC-APCI-ITFT
LC-APCI-TOF
MS Type
All
MS
MS2
Ion Mode
Positive
Negative
Both
Peak Search (Option)
m/z
,
,
Tolerance of
m/z