| SpectraBase Spectrum ID |
2FzbJwG0O7R |
| Name |
2-Chloroacetyl-1-ethyl-3-hydroxy-1,3-diazacyclopent[a]azulenium hydroxide |
| Alternate Name(s) |
2-(chloroacetyl)-1-ethyl-1H-cyclohepta[4,5]pyrrolo[1,2-a]imidazol-4-ium-3-olate
(1E)-2-chloro-1-(1-ethyl-3-oxo-2-cyclohepta[2,3]pyrrolo[4,5-c]imidazol-4-iumylidene)ethanolate
(1E)-2-chloro-1-(1-ethyl-3-oxocyclohepta[2,3]pyrrolo[4,5-c]imidazol-4-ium-2-ylidene)ethanolate
(1E)-2-chloro-1-(1-ethyl-3-oxo-cyclohepta[2,3]pyrrolo[4,5-c]imidazol-4-ium-2-ylidene)ethanolate
(1E)-2-chloranyl-1-(1-ethyl-3-oxidanylidene-cyclohepta[2,3]pyrrolo[4,5-c]imidazol-4-ium-2-ylidene)ethanolate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C15H13ClN2O2 |
| InChI |
InChI=1S/C15H13ClN2O2/c1-2-17-13-8-10-6-4-3-5-7-11(10)18(13)15(20)14(17)12(19)9-16/h3-8H,2,9H2,1H3 |
| InChIKey |
GJROBTZCFCGTFQ-UHFFFAOYSA-N |
| Molecular Weight |
288.734 g/mol |
| SMILES |
c12[n+](c(c([n]2CC)C(=O)CCl)[O-])c2c(c1)ccccc2 |
| SPLASH |
splash10-0a4i-0960000000-af92f8bdb06c68341670 |
| Source of Spectrum |
KC-0-2354-5 |
| Wiley ID |
786479 |
![2-Chloroacetyl-1-ethyl-3-hydroxy-1,3-diazacyclopent[a]azulenium hydroxide](/api/spectrum/2FzbJwG0O7R/structure.png?h=300&w=458 "2-Chloroacetyl-1-ethyl-3-hydroxy-1,3-diazacyclopent[a]azulenium hydroxide")
