RInChI=1.00.1S/C12H12O/c1-3-9-13-10-12-7-5-11(4-2)6-8-12/h1,4-8H,2,9-10H2<>C3H4O/c1-2-3-4/h1,4H,3H2!C9H9Cl/c1-2-8-3-5-9(7-10)6-4-8/h2-6H,1,7H2!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/E:(5,6)(7,8)/rA:13CCCCCCCCCCCCO/rB:;t1;d2;;;s5;d6;s3;;s4d5s6;d7s8s10;s9s10;/rC:;;;;;;;;;;;;;<>0/N:1,2,3,4/rA:4CCCO/rB:t1;s2;s3;/rC:;;;;!0/N:1,2,3,4,5,6,7,8,9,10/E:(3,4)(5,6)/rA:10CCCCCCCCCCl/rB:d1;;;s3;d4;;s2d3s4;d5s6s7;s7;/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-JQOVUVNPZUYORO-UHFFFAOYSA-N--TVDSBUOJIPERQY-UHFFFAOYSA-N-ZRZHXNCATOYMJH-UHFFFAOYSA-N-BZKBCQXYZZXSCO-UHFFFAOYSA-N--ZMXDDKWLCZADIW-UHFFFAOYSA-N
Short-RInChIKey=SA-BUHFF-JQOVUVNPZU-MBPKHNUTII-ZMXDDKWLCZ-NUHFF-NUHFF-NUHFF-ZZZ
Web-RInChIKey=YZNBQIOFNRZUKUHKT-NUHFFFADPSCTJSA