SpectraBase Spectrum ID |
JVmdA8P3mpg |
Name |
2(1H)-Naphthalenone, 3,4-dihydro-8-methoxy-3-(2-nitro-1-phenylethyl)-, [S-(R*,S*)]- |
CAS Registry Number |
87732-62-5 |
Comments |
Less than 3 mono-isotopic peaks |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C19H19NO4 |
InChI |
InChI=1S/C19H19NO4/c1-24-19-9-5-8-14-10-16(18(21)11-15(14)19)17(12-20(22)23)13-6-3-2-4-7-13/h2-9,16-17H,10-12H2,1H3/t16-,17-/m0/s1 |
InChIKey |
YQRQWQURKIMISE-IRXDYDNUSA-N |
Molecular Weight |
325.364 g/mol |
SMILES |
[C@]1(C(Cc2c(C1)cccc2OC)=O)([C@@](CN(=O)=O)(c1ccccc1)[H])[H] |
SPLASH |
splash10-004i-0900000000-69c018210859893002c4 |
Source of Spectrum |
K-116-3095-0 |
Synonyms |
(-)-(3S,1'R)-3,4-dihydro-8-methoxy-3-(2-nitro-1-phenylethyl)-2(1H)-naphthalenone
(3S)-8-methoxy-3-[(1R)-2-nitro-1-phenylethyl]-3,4-dihydro-2(1H)-naphthalenone |
Wiley ID |
1324045 |