SpectraBase Spectrum ID |
H7F55YvZkwK |
Name |
[1R*,2S*]-1-acetyl-2-methoxy-3-cyclohexen-1-yl p-nitrobenzoate |
CAS Registry Number |
111945-74-5 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C16H17NO6 |
InChI |
InChI=1S/C16H17NO6/c1-11(18)16(10-4-3-5-14(16)22-2)23-15(19)12-6-8-13(9-7-12)17(20)21/h3,5-9,14H,4,10H2,1-2H3/t14-,16-/m0/s1 |
InChIKey |
MHRLDLRGFTXLBU-HOCLYGCPSA-N |
Molecular Weight |
319.313 g/mol |
SMILES |
[C@]1(OC(c2ccc(N(=O)=O)cc2)=O)(C(=O)C)[C@](C=CCC1)(OC)[H] |
SPLASH |
splash10-0udi-3910000000-9e92cfa63e0e99534f86 |
Source of Spectrum |
J-55-1033-20 |
Synonyms |
(1R,2S)-1-acetyl-2-methoxy-3-cyclohexen-1-yl 4-nitrobenzoate |
Wiley ID |
1319272 |