SpectraBase Spectrum ID |
4HI0HOVcV3O |
Name |
Ethyl 5-Oxo-6-azatricyclo[4.3.1(2,9).0]dec-3-ene-endo-10-carboxylate |
Comments |
Less than 3 mono-isotopic peaks |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C12H15NO3 |
InChI |
InChI=1S/C12H15NO3/c1-2-16-12(15)10-7-3-4-9(14)13-6-5-8(10)11(7)13/h3-4,7-8,10-11H,2,5-6H2,1H3/t7-,8+,10+,11-/m0/s1 |
InChIKey |
UZCMSLQTTMKSPC-URPMGSGRSA-N |
Molecular Weight |
221.256 g/mol |
SMILES |
[C@]12(N3C(=O)C=C[C@@]2([H])[C@]([C@]1(CC3)[H])(C(=O)OCC)[H])[H] |
SPLASH |
splash10-0002-9030000000-ef19af6231ef8fb1ad9f |
Source of Spectrum |
J-57-5711-14 |
Synonyms |
(1S,1aR,6aS,6bR)-4-Oxo-1a,2,3,4,6a,6b-hexahydro-1H-3a-aza-cyclobuta[cd]indene-1-carboxylic acid ethyl ester
ethyl 5-oxo-6-azatricyclo[4.3.1.0(2,9)]dec-3-ene-10-carboxylate |
Wiley ID |
1221330 |