SpectraBase Spectrum ID |
1kRjFg1Ll2t |
Name |
grossularine-2 |
CAS Registry Number |
102488-58-4 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C21H17N5O2 |
InChI |
InChI=1S/C21H17N5O2/c1-26(2)21-24-16-15-13-5-3-4-6-14(13)22-20(15)23-18(17(16)25-21)19(28)11-7-9-12(27)10-8-11/h3-10,27H,1-2H3,(H,22,23)(H,24,25) |
InChIKey |
OGSOWFWOXWWJSA-UHFFFAOYSA-N |
Molecular Weight |
371.400 g/mol |
SMILES |
[nH]1c(nc2c(C(c3ccc(cc3)O)=O)nc3c(c12)c1c(cccc1)[nH]3)N(C)C |
SPLASH |
splash10-00yi-2924000000-c8ca342d99017243b633 |
Source of Spectrum |
F-45-3450-5 |
Wiley ID |
1354974 |