| SpectraBase Spectrum ID |
BJ3hvB9GlTq |
| Name |
trans-3,4-Dihydro-2,2-dimethyl-5-nitro-4-isopropylamino-2H-1-benzopyran-3-ol |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C14H20N2O4 |
| InChI |
InChI=1S/C14H20N2O4/c1-8(2)15-12-11-9(16(18)19)6-5-7-10(11)20-14(3,4)13(12)17/h5-8,12-13,15,17H,1-4H3/t12-,13+/m0/s1 |
| InChIKey |
MTHZVAVPUDPAET-QWHCGFSZSA-N |
| Molecular Weight |
280.324 g/mol |
| SMILES |
O[C@]1(C(Oc2c([C@@]1(NC(C)C)[H])c(ccc2)N(=O)=O)(C)C)[H] |
| SPLASH |
splash10-0a4i-7950000000-fe8cf97d6769f0620774 |
| Source of Spectrum |
O-20-441-10 |
| Synonyms |
(3R,4S)-4-(isopropylamino)-2,2-dimethyl-5-nitro-3,4-dihydro-2H-chromen-3-ol |
| Wiley ID |
1283656 |
