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7-氨基-4-甲基香豆素-3-乙酸(AMCA)CAS号 : 106562-32-7 Compound CID : 129367分子式: C12H11NO4 分子量: 233.22IUPAC Name: 2-(7-amino-4-methyl-2-oxochromen-3-yl)acetic acidSMILES: CC1=C(C(=O)OC2=C1C=CC(=C2)N)CC(=O)OInChIKey: QEQDLKUMPUDNPG-UHFFFAOYSA-NInChI: InChI=1S/C12H11NO4/c1-6-8-3-2-7(13)4-10(8)17-12(16)9(6)5-11(14)15/h2-4H,5,13H2,1H3,(H,14,15)
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天然辣椒碱分子式: C18H27NO3 分子量: 305.41IUPAC Name: (E)-N-[(4-hydroxy-3-methoxyphenyl)methyl]-8-methylnon-6-enamideSMILES: CC(C)C=CCCCCC(=O)NCC1=CC(=C(C=C1)O)OCInChIKey: YKPUWZUDDOIDPM-SOFGYWHQSA-NInChI: InChI=1S/C18H27NO3/c1-14(2)8-6-4-5-7-9-18(21)19-13-15-10-11-16(20)17(12-15)22-3/h6,8,10-12,14,20H,4-5,7,9,13H2,1-3H3,(H,19,21)/b8-6+
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天然辣椒碱分子式: C18H27NO3 分子量: 305.41IUPAC Name: (E)-N-[(4-hydroxy-3-methoxyphenyl)methyl]-8-methylnon-6-enamideSMILES: CC(C)C=CCCCCC(=O)NCC1=CC(=C(C=C1)O)OCInChIKey: YKPUWZUDDOIDPM-SOFGYWHQSA-NInChI: InChI=1S/C18H27NO3/c1-14(2)8-6-4-5-7-9-18(21)19-13-15-10-11-16(20)17(12-15)22-3/h6,8,10-12,14,20H,4-5,7,9,13H2,1-3H3,(H,19,21)/b8-6+
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1-(2-吡啶基)-2-萘酚 (PAN)CAS号 : 85-85-8分子式: C15H11N3O 分子量: 249.27IUPAC Name: 1-(pyridin-2-yldiazenyl)naphthalen-2-olSMILES: C1=CC=C2C(=C1)C=CC(=C2N=NC3=CC=CC=N3)OInChIKey: LLYOXZQVOKALCD-UHFFFAOYSA-NInChI: InChI=1S/C15H11N3O/c19-13-9-8-11-5-1-2-6-12(11)15(13)18-17-14-7-3-4-10-16-14/h1-10,19H
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2,4-十二碳二烯醛CAS号 : 21662-16-8 Compound CID : 5367530分子式: C12H20O 分子量: 180.29IUPAC Name: (2E,4E)-dodeca-2,4-dienalSMILES: CCCCCCCC=CC=CC=OInChIKey: QKTZBZWNADPFOL-BNFZFUHLSA-NInChI: InChI=1S/C12H20O/c1-2-3-4-5-6-7-8-9-10-11-12-13/h8-12H,2-7H2,1H3/b9-8+,11-10+
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2,5-二甲基-3-氧代-(2H)-fur-4-基 丁酸盐CAS号 : 114099-96-6 Compound CID : 19872333分子式: C10H14O4 分子量: 198.22IUPAC Name: (2,5-dimethyl-4-oxofuran-3-yl) butanoateSMILES: CCCC(=O)OC1=C(OC(C1=O)C)CInChIKey: JOLGAERKCZYHLF-UHFFFAOYSA-NInChI: InChI=1S/C10H14O4/c1-4-5-8(11)14-10-7(3)13-6(2)9(10)12/h6H,4-5H2,1-3H3
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2-丁基-2-辛烯醛CAS号 : 13019-16-4 Compound CID : 5362697分子式: C12H22O 分子量: 182.3IUPAC Name: (Z)-2-butyloct-2-enalSMILES: CCCCCC=C(CCCC)C=OInChIKey: LYGMPIZYNJGJKP-BENRWUELSA-NInChI: InChI=1S/C12H22O/c1-3-5-7-8-10-12(11-13)9-6-4-2/h10-11H,3-9H2,1-2H3/b12-10-
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2-甲基-3-呋喃硫醇CAS号 : 28588-74-1 Compound CID : 34286分子式: C5H6OS 分子量: 114.17IUPAC Name: 2-methylfuran-3-thiolSMILES: CC1=C(C=CO1)SInChIKey: RUYNUXHHUVUINQ-UHFFFAOYSA-NInChI: InChI=1S/C5H6OS/c1-4-5(7)2-3-6-4/h2-3,7H,1H3
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Arsenazo III分子式: C22H18(As2)N4O14S2 分子量: 776.37IUPAC Name: 3,6-bis[(2-arsonophenyl)diazenyl]-4,5-dihydroxynaphthalene-2,7-disulfonic acidSMILES: C1=CC=C(C(=C1)N=NC2=C(C3=C(C(=C(C=C3C=C2S(=O)(=O)O)S(=O)(=O)O)N=NC4=CC=CC=C4[As](=O)(O)O)O)O)[As](=O)(O)OInChIKey: UQHVTNUJRKELCE-UHFFFAOYSA-NInChI: InChI=1S/C22H18As2N4O14S2/c29-21-18-11(9-16(43(37,38)39)19(21)27-25-14-7-3-1-5-12(14)23(31,32)33)10-17(44(40,41)42)20(22(18)30)28-26-15-8-4-2-6-13(15)24(34,35)36/h1-10,29-30H,(H2,31,32,33)(H2,34,35,36)(H,37,38,39)(H,40,41,42)
