7 6 0 0001 0 0 0 0 0999 V2000 5.1350 -0.4400 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 4.2690 1.0600 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 2.5369 0.0600 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 3.4030 -0.4400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 4.2690 0.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.2500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 2.5369 0.6800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 1 5 1 0 2 5 2 0 4 3 1 1 3 6 1 0 3 7 1 0 4 5 1 0 M END > 4 3 5 > InChI=1S/C2H5NO2/c3-1-2(4)5/h1,3H2,(H,4,5)/i1D,3+1/t1-/m1/s1 > DHMQDGOQFOQNFH-JMMGCJDKSA-N > 1/1/N:4,5,3,1,2/E:(4,5)/I:/E:m/it:iM/rA:10cOON.i15CCH.i2HHHH/rB:;;p3;s1d2s4;s4;s4;s3;s3;s1;/rC:5.135,-.44,0;4.269,1.06,0;2.5369,.06,0;3.403,-.44,0;4.269,.06,0;3.403,-1.06,0;3.403,.18,0;2,-.25,0;2.5369,.68,0;5.6719,-.13,0; > C2 H5 N O2 > 77.06617 > O([H])C([C@@]([H])([2H])[15N]([H])[H])=O > 9575618 $$$$