SpectraBase Spectrum ID |
JEvlrjhb4wy |
Name |
Indigotin |
CAS Registry Number |
482-89-3 |
Classification |
Chemical |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
262.074227568 u |
Formula |
C16H10N2O2 |
InChI |
InChI=1S/C16H10N2O2/c19-15-9-5-1-3-7-11(9)17-13(15)14-16(20)10-6-2-4-8-12(10)18-14/h1-8,17-18H/b14-13+ |
InChIKey |
COHYTHOBJLSHDF-BUHFOSPRSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
262.268 g/mol |
Nominal Mass |
262 u |
Quality |
917 |
Retention Index |
2246 |
SMILES |
C=12N\C(=C\3NC=4C(C3=O)=CC=CC4)C(C2=CC=CC1)=O |
SPLASH |
splash10-03di-4890000000-168cd8fe8942925c65f5 |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
Cystoceva
Indigo Blue
(2E)-2-(3-Oxo-1H-indol-2-ylidene)-1H-indol-3-one |
Technique |
GC/MS |
Wiley ID |
DD2024_001719 |