53384058 -OEChem-03292401542D 30 32 0 0 0 0 0 0 0999 V2000 5.2619 -1.9065 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6353 -0.6893 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.4065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.4065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 -2.7112 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 -1.1018 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.9065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.9065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9889 -0.1513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.4065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.4065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9674 0.0550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2781 1.0055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6103 1.7498 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2566 1.2117 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9209 2.7003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5673 2.1622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8994 2.9065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4272 -3.2782 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2156 -3.0205 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.5265 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.2865 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5749 0.3102 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -2.7165 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -1.0965 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0036 1.6219 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6707 0.7502 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5069 3.1618 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1739 2.2901 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0920 3.4958 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 5 1 0 0 0 0 1 6 1 0 0 0 0 2 12 2 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 7 2 0 0 0 0 4 6 1 0 0 0 0 4 8 2 0 0 0 0 5 19 1 0 0 0 0 5 20 1 0 0 0 0 6 9 2 0 0 0 0 7 10 1 0 0 0 0 7 21 1 0 0 0 0 8 11 1 0 0 0 0 8 22 1 0 0 0 0 9 12 1 0 0 0 0 9 23 1 0 0 0 0 10 11 2 0 0 0 0 10 24 1 0 0 0 0 11 25 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 14 16 1 0 0 0 0 14 26 1 0 0 0 0 15 17 2 0 0 0 0 15 27 1 0 0 0 0 16 18 2 0 0 0 0 16 28 1 0 0 0 0 17 18 1 0 0 0 0 17 29 1 0 0 0 0 18 30 1 0 0 0 0 M END > 53384058 > 1 > 339 > 2 > 0 > 2 > AAADccB4MAAAAAAAAAAAAAAAAAAAASAAAAAwYAAAAAAAAEgBQAAAGgAAAAAADASgmAIwAIAABACIAqBSAAACCAAkIAAIiAEACMgIJjKANRiCMQAkwAEIqYeIyKCOgAAAAAAQAAAAAAAAACAAAAAAAAAAAA== > (2Z)-2-(3H-isobenzofuran-1-ylidene)-1-phenyl-ethanone > (2Z)-2-(3H-isobenzofuran-1-ylidene)-1-phenylethanone > (2Z)-2-(3H-2-benzofuran-1-ylidene)-1-phenylethanone > (2Z)-2-(3H-2-benzofuran-1-ylidene)-1-phenylethanone > (2Z)-2-(3H-2-benzofuran-1-ylidene)-1-phenyl-ethanone > (2Z)-1-phenyl-2-phthalan-1-ylidene-ethanone > InChI=1S/C16H12O2/c17-15(12-6-2-1-3-7-12)10-16-14-9-5-4-8-13(14)11-18-16/h1-10H,11H2/b16-10- > WWPOXRDUIFCTJB-YBEGLDIGSA-N > 3 > 236.083729621 > C16H12O2 > 236.26 > C1C2=CC=CC=C2C(=CC(=O)C3=CC=CC=C3)O1 > C1C2=CC=CC=C2/C(=C/C(=O)C3=CC=CC=C3)/O1 > 26.3 > 236.083729621 > 0 > 18 > 0 > 0 > 1 > 0 > 0 > 1 > -1 > 1 5 255 > 10 11 8 13 14 8 13 15 8 14 16 8 15 17 8 16 18 8 17 18 8 3 4 8 3 7 8 4 8 8 7 10 8 8 11 8 $$$$