SpectraBase Compound ID | 7KP7ybsOrwA |
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InChI | InChI=1S/C19H22N2O3/c1-3-14-11-8-17-19(9-15(20-14)12(11)10-24-17)13-6-4-5-7-16(13)21(23-2)18(19)22/h4-7,11-12,15,17H,3,8-10H2,1-2H3/t11-,12+,15-,17-,19?/m0/s1 |
InChIKey | BIGABVPVCRHEES-JIFNFBFSSA-N |
Mol Weight | 326.4 g/mol |
Molecular Formula | C19H22N2O3 |
Exact Mass | 326.163043 g/mol |
SpectraBase Spectrum ID | 1szgA0nDtHd |
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Name | Humantenmine |
CAS Registry Number | 82354-38-9 |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C19H22N2O3 |
InChI | InChI=1S/C19H22N2O3/c1-3-14-11-8-17-19(9-15(20-14)12(11)10-24-17)13-6-4-5-7-16(13)21(23-2)18(19)22/h4-7,11-12,15,17H,3,8-10H2,1-2H3/t11-,12+,15-,17-,19?/m0/s1 |
InChIKey | BIGABVPVCRHEES-JIFNFBFSSA-N |
Molecular Weight | 326.396 g/mol |
SMILES | CCC=1[C@]2(C[C@]3(C4(C[C@@]([C@@]2(CO3)[H])(N1)[H])c1ccccc1N(C4=O)OC)[H])[H] |
SPLASH | splash10-004j-9844000000-212caa34ae78364f0df3 |
Source of Spectrum | CD-41-0-0 |
Wiley ID | 1324879 |