RInChI=1.00.1S/C11H17NO2/c1-6-8-12(9-7-2)10(13)14-11(3,4)5/h1,7H,2,8-9H2,3-5H3<>C3H5Br/c1-2-3-4/h2H,1,3H2!C8H13NO2/c1-5-6-9-7(10)11-8(2,3)4/h1H,6H2,2-4H3,(H,9,10)!Na.H/q+1;-1<>C3H7NO/c1-4(2)3-5/h3H,1-2H3/d-
RAuxInfo=1.00.1/0/N:1,2,3,4,5,6,7,8,9,10,11,12,13,14/E:(3,4,5)/rA:14CCCCCCCCCCCNOO/rB:;;;;t1;d2;s6;s7;;s3s4s5;s8s9s10;d10;s10s11;/rC:;;;;;;;;;;;;;;<>0/N:1,2,3,4/rA:4CCCBr/rB:d1;s2;s3;/rC:;;;;!1/N:1,2,3,4,5,6,7,8,9,10,11/E:(2,3,4)/rA:11CCCCCCCCNOO/rB:;;;t1;s5;;s2s3s4;s6d7;s7;s7s8;/rC:;;;;;;;;;;;!0/N:1;2/rA:2Na+H-/rB:;/rC:;;<>0/N:1,2,3,4,5/E:(1,2)/rA:5CCCNO/rB:;;s1s2s3;d3;/rC:;;;;;
Long-RInChIKey=SA-BUHFF-JJOBBHMBMRQQHU-UHFFFAOYSA-N--BHELZAPQIKSEDF-UHFFFAOYSA-N-DSPYCWLYGXGJNJ-UHFFFAOYSA-N-BZKBCQXYZZXSCO-UHFFFAOYSA-N--ZMXDDKWLCZADIW-UHFFFAOYSA-N
Short-RInChIKey=SA-BUHFF-JJOBBHMBMR-NJEVKVSWLK-ZMXDDKWLCZ-NUHFF-NUHFF-NUHFF-ZZZ
Web-RInChIKey=RJKOZNGKWPMRTLGKF-NUHFFFADPSCTJSA