SpectraBase Spectrum ID |
1KHnSX6X9k |
Name |
(1S,2R)-(-)-1-[N-(3'-tert-Butyl-5'-nitrosalicilidene)amino]-2-indanol |
Appearance |
Yellow solid |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
354.157957192 u |
Formula |
C20H22N2O4 |
InChI |
InChI=1S/C20H22N2O4/c1-20(2,3)16-10-14(22(25)26)8-13(19(16)24)11-21-18-15-7-5-4-6-12(15)9-17(18)23/h4-8,10-11,17-18,23-24H,9H2,1-3H3/t17-,18+/m1/s1 |
InChIKey |
NYQGVYNYPYTFRT-MSOLQXFVSA-N |
Ionization Type |
EI |
Literature Reference DOI |
10.3998/ark.5550190.0004.b02 |
Molecular Weight |
354.406 g/mol |
Optical Rotation |
[a]D25 = -29.33 (c = 0.50, CH2Cl2) |
Quality |
197 |
SMILES |
O[C@]1([C@@](N=CC2=CC(=CC(=C2O)C(C)(C)C)[N+](=O)[O-])(C2=CC=CC=C2C1)[H])[H] |
SPLASH |
splash10-0pe9-3935000000-656dd74ee2ae50bba38e |
Source of Spectrum |
ARK-2003-11-14 (DOI: 10.3998/ark.5550190.0004.b02) |
Wiley ID |
1899727 |