mstof_calculator.xlsx

	A	B	C	D	E	F	G	H	I	J	K	L	M	N	O	P	Q	R	S	T	U	V
1			mass of electron	0.000549
2	Mass	Mass	[M+H]	Mass	Compound	Description	CAS	C	H	D	N	O	P	S	Cl	F	Br	Si	Na	K	W	Sn
3	Error (ppm)	Measured	Calculated	Calculated				12.000000	1.007825	2.014102	14.003074	15.994915	30.973762	31.972071	34.968853	18.998403	78.918338	27.976927	22.989769	39.098300	183.950953	119.902199

4	0.1	285.02077	285.020750	284.01347	Sulfachloropyridazine			10	9		4	2		1	1
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