##TITLE=Heptanoic acid
##JCAMP-DX=4.24
##DATA TYPE=INFRARED SPECTRUM
##ORIGIN=Sadtler Research Labs Under US-EPA Contract
##OWNER=NIST Standard Reference Data Program
Collection (C) 2003 copyright by the U.S. Secretary of Commerce
on behalf of the United States of America. All rights reserved.
##CAS REGISTRY NO=111-14-8
##MOLFORM=C7H14O2
##$NIST SOURCE=MSDC-IR
##STATE=gas
##XUNITS=1/CM
##YUNITS=ABSORBANCE
##XFACTOR=1.0
##YFACTOR=0.000071198
##DELTAX=4.0
##FIRSTX=450.0
##LASTX=3966.0
##FIRSTY=0.014453
##MAXX=3966
##MINX=450
##MAXY=0.71198
##MINY=0
##NPOINTS=880
##XYDATA=(X++(Y..Y))
450.0 203 225 225 220 220 239 257 285 322 365
490.0 422 475 529 608 658 692 680 670 690 728
530.0 758 794 871 1027 1211 1333 1452 1574 1412 1376
570.0 1268 1297 1338 1393 1491 1566 1634 1687 1682 1685
610.0 1687 1678 1636 1620 1604 1544 1458 1283 1077 885
650.0 753 655 592 549 528 465 471 453 443 414
690.0 413 399 392 391 406 433 465 492 507 505
730.0 476 421 367 313 271 237 224 221 211 176
770.0 149 118 104 76 61 62 68 63 71 62
810.0 60 55 50 41 35 41 14 29 37 53
850.0 67 82 100 113 121 144 156 157 144 143
890.0 135 129 114 109 100 85 83 75 70 77
930.0 77 77 76 71 71 64 72 77 91 108
970.0 130 154 167 189 204 245 261 290 327 362
1010.0 391 413 432 447 454 465 469 490 532 596
1050.0 676 792 939 1112 1331 1610 1942 2343 2809 3333
1090.0 3899 4368 4555 4457 4081 3637 3298 3167 3287 3605
1130.0 4029 4403 4611 4546 4266 3820 3304 2824 2454 2165
1170.0 1940 1759 1617 1536 1487 1470 1450 1431 1381 1311
1210.0 1225 1139 1039 947 876 824 783 748 720 691
1250.0 679 685 693 702 710 718 725 738 738 735
1290.0 705 665 634 614 609 589 584 572 561 577
1330.0 606 671 747 815 875 929 971 1034 1124 1199
1370.0 1299 1425 1551 1629 1632 1504 1299 1042 827 676
1410.0 600 554 568 571 607 639 660 651 672 713
1450.0 773 881 950 1011 984 907 750 591 446 332
1490.0 229 171 126 100 84 64 68 49 50 30
1530.0 31 27 25 7 23 20 15 7 0 7
1570.0 9 15 10 12 14 18 15 19 17 19
1610.0 19 19 29 27 31 29 34 32 36 32
1650.0 41 35 57 51 61 65 81 87 105 117
1690.0 138 159 191 227 281 348 433 555 718 909
1730.0 1101 1267 1477 1756 2135 2608 3212 3947 4926 6213
1770.0 7730 9196 10000 9979 8968 7426 5767 4452 3383 2557
1810.0 1925 1415 1032 752 552 415 322 260 217 177
1850.0 156 130 118 104 99 81 77 69 64 57
1890.0 60 52 52 45 51 45 45 38 41 37
1930.0 38 39 39 42 37 39 40 40 32 34
1970.0 34 34 34 33 28 30 29 29 29 22
2010.0 22 30 25 31 30 30 24 27 25 25
2050.0 24 25 25 21 28 19 19 20 21 21
2090.0 21 22 16 21 21 20 20 21 21 19
2130.0 26 20 26 26 25 25 30 33 32 32
2170.0 36 38 38 38 38 45 44 44 44 41
2210.0 36 45 40 42 42 42 42 42 42 41
2250.0 41 41 41 41 41 33 33 34 39 33
2290.0 33 35 34 34 36 36 30 28 29 26
2330.0 27 21 22 15 22 27 21 25 21 16
2370.0 10 17 18 28 29 28 33 27 34 33
2410.0 33 26 34 27 32 29 25 25 31 30
2450.0 23 23 18 24 23 22 18 22 22 22
2490.0 17 22 22 22 21 21 15 21 22 28
2530.0 22 27 27 26 26 29 30 22 30 29
2570.0 30 38 30 30 30 38 35 35 37 37
2610.0 38 38 39 45 45 45 45 55 49 61
2650.0 61 60 69 69 73 69 76 75 82 83
2690.0 81 77 77 77 77 77 69 69 77 76
2730.0 83 84 92 105 113 113 105 105 101 99
2770.0 98 99 105 113 127 134 149 170 179 194
2810.0 210 228 248 277 313 347 397 468 577 737
2850.0 970 1290 1685 2096 2473 2728 2823 2863 2825 2615
2890.0 2384 2111 1923 1943 2109 2418 2860 3418 4093 4824
2930.0 5542 6104 6466 6537 6284 5886 5422 5145 5121 5328
2970.0 5347 4818 4011 2925 2033 1488 1122 888 715 602
3010.0 522 454 405 370 337 307 291 268 250 233
3050.0 218 205 190 184 182 176 171 164 161 158
3090.0 158 145 143 144 136 136 136 130 135 130
3130.0 131 130 127 123 127 120 110 117 125 117
3170.0 118 117 112 112 105 105 104 105 99 91
3210.0 91 85 85 86 84 79 79 79 71 68
3250.0 74 60 64 65 60 60 53 52 53 44
3290.0 39 40 38 38 39 39 44 46 33 39
3330.0 33 32 46 34 34 32 29 41 23 26
3370.0 34 27 27 20 20 29 20 20 20 20
3410.0 24 30 24 33 25 19 37 25 26 30
3450.0 29 13 19 29 31 26 32 28 33 48
3490.0 40 33 43 62 77 76 77 86 99 139
3530.0 135 154 159 182 223 249 293 432 648 1171
3570.0 2196 3344 3634 3526 2553 1370 779 508 302 208
3610.0 180 139 110 86 71 96 64 46 58 71
3650.0 102 76 54 43 33 59 74 60 41 24
3690.0 68 40 26 45 26 50 79 42 48 74
3730.0 36 69 76 56 71 97 54 57 44 41
3770.0 45 25 25 38 37 27 40 48 77 59
3810.0 42 24 79 55 59 35 45 58 71 28
3850.0 31 98 55 43 76 68 72 41 74 54
3890.0 68 38 59 69 77 12 28 43 45 42
3930.0 34 53 25 34 42 56 31 35 38 34
##END=