HMDB0037151 RDKit 3D 2-Isopropyl-5-methylpyrazine 22 22 0 0 0 0 0 0 0 0999 V2000 3.7989 0.2448 0.3438 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3325 0.1889 0.1818 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4522 0.5464 1.1782 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1373 0.4562 0.9212 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.3511 0.0343 -0.2606 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7969 -0.0646 -0.5423 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5312 1.2299 -0.2831 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3393 -1.1746 0.3661 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5371 -0.3221 -1.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8414 -0.2314 -0.9955 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1539 -0.7613 0.6406 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1126 0.9814 1.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2475 0.4696 -0.6374 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8427 0.8866 2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9332 -0.4331 -1.5731 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8523 2.0734 -0.0513 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2793 1.0529 0.5204 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1140 1.4740 -1.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7841 -1.1536 1.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2207 -2.1647 -0.1498 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4204 -0.9788 0.4755 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1664 -0.6715 -2.2324 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 3 4 1 0 4 5 2 0 5 6 1 0 6 7 1 0 6 8 1 0 5 9 1 0 9 10 2 0 10 2 1 0 1 11 1 0 1 12 1 0 1 13 1 0 3 14 1 0 6 15 1 0 7 16 1 0 7 17 1 0 7 18 1 0 8 19 1 0 8 20 1 0 8 21 1 0 9 22 1 0 M END