| SpectraBase Spectrum ID |
4Q4k3UDoJtZ |
| Name |
2,5-Cyclohexadien-1-ol, 3-chloro-2,4,6-trimethyl-4-nitro-, acetate (ester), trans- |
| CAS Registry Number |
67396-80-9 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C11H14ClNO4 |
| InChI |
InChI=1S/C11H14ClNO4/c1-6-5-11(4,13(15)16)10(12)7(2)9(6)17-8(3)14/h5,9H,1-4H3/t9-,11-/m1/s1 |
| InChIKey |
XWZPCVSMEIHODY-MWLCHTKSSA-N |
| Molecular Weight |
259.689 g/mol |
| SMILES |
[C@]1(C(=C(C)[C@@](C(=C1)C)(OC(=O)C)[H])Cl)(N(=O)=O)C |
| SPLASH |
splash10-0229-0970000000-8643742bbec20b971727 |
| Source of Spectrum |
I-56-1354-0 |
| Synonyms |
(1R,4R)-3-chloro-2,4,6-trimethyl-4-nitro-2,5-cyclohexadien-1-yl acetate
3-Chloro-2,4,6-trimethyl-4-nitrocyclohexa-2,5-dienyl acetate |
| Wiley ID |
1262493 |
