90239 -OEChem-03282409422D 27 28 0 0 0 0 0 0 0999 V2000 7.8133 -1.2447 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8133 0.3647 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 1.5600 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -1.4400 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -0.9400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -1.4400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 -0.9400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 0.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -1.4400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 0.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 0.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -0.9400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3969 -0.4400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 2.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8705 -1.9150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6675 -1.9150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -2.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8015 -0.4651 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0044 -0.4651 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8578 -0.8547 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8578 -0.0253 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.1300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -2.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4450 2.5969 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 2.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8250 1.5231 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 7 1 0 0 0 0 1 13 1 0 0 0 0 2 8 1 0 0 0 0 2 13 1 0 0 0 0 3 10 1 0 0 0 0 3 14 1 0 0 0 0 4 12 1 0 0 0 0 4 23 1 0 0 0 0 4 24 1 0 0 0 0 5 6 1 0 0 0 0 5 9 2 0 0 0 0 5 11 1 0 0 0 0 6 12 1 0 0 0 0 6 15 1 0 0 0 0 6 16 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 8 10 1 0 0 0 0 9 17 1 0 0 0 0 10 11 2 0 0 0 0 11 18 1 0 0 0 0 12 19 1 0 0 0 0 12 20 1 0 0 0 0 13 21 1 0 0 0 0 13 22 1 0 0 0 0 14 25 1 0 0 0 0 14 26 1 0 0 0 0 14 27 1 0 0 0 0 M END > 90239 > 1 > 188 > 4 > 1 > 3 > AAADccByMAAAAAAAAAAAAAAAAAAAASAAAAAwAAAAAAAAAEgBAAAAHgAQAAAADATBmAcyDoBABACAAiBCAAACCAAgIAAAiIAGiIgdJyKEsRugMCIl0BUOqAeQ8LwOIAABCAAAQABAAAIQAACAAAAAAAAAAA== > 2-(7-methoxy-1,3-benzodioxol-5-yl)ethanamine > 2-(7-methoxy-1,3-benzodioxol-5-yl)ethanamine > 2-(7-methoxy-1,3-benzodioxol-5-yl)ethanamine > 2-(7-methoxy-1,3-benzodioxol-5-yl)ethanamine > 2-(7-methoxy-1,3-benzodioxol-5-yl)ethanamine > 2-(7-methoxy-1,3-benzodioxol-5-yl)ethylamine > InChI=1S/C10H13NO3/c1-12-8-4-7(2-3-11)5-9-10(8)14-6-13-9/h4-5H,2-3,6,11H2,1H3 > ORXQUAPZHKCCAX-UHFFFAOYSA-N > 1.2 > 195.08954328 > C10H13NO3 > 195.21 > COC1=CC(=CC2=C1OCO2)CCN > COC1=CC(=CC2=C1OCO2)CCN > 53.7 > 195.08954328 > 0 > 14 > 0 > 0 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 10 11 8 5 11 8 5 9 8 7 8 8 7 9 8 8 10 8 $$$$