SpectraBase Spectrum ID |
HFP15vNNxwx |
Name |
Carbamic acid, [5-methyl-6-(3-oxo-1-hexenyl)-2-cyclohexen-1-yl]-, ethyl ester, [1.alpha.,5.beta.,6.alpha.(E)]-(.+-.)- |
CAS Registry Number |
63897-57-4 |
Comments |
Less than 3 mono-isotopic peaks |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C16H25NO3 |
InChI |
InChI=1S/C16H25NO3/c1-4-7-13(18)10-11-14-12(3)8-6-9-15(14)17-16(19)20-5-2/h6,9-12,14-15H,4-5,7-8H2,1-3H3,(H,17,19)/b11-10+/t12-,14+,15-/m1/s1 |
InChIKey |
DLYNNMZNOHVSKJ-WTEYCDQGSA-N |
Molecular Weight |
279.380 g/mol |
SMILES |
N(C(=O)OCC)[C@]1([C@@](\C=C\C(=O)CCC)([C@@](CC=C1)(C)[H])[H])[H] |
SPLASH |
splash10-0006-0900000000-92588c2724d5f30eac7c |
Source of Spectrum |
C-100-5183-0 |
Synonyms |
ethyl (1R,5R,6R)-5-methyl-6-[(1E)-3-oxo-1-hexenyl]-2-cyclohexen-1-ylcarbamate
N-Carboxy-1-amino-5-methyl-6-(3-oxyhex-1-enyl)-cyclohex-2-en ethyl ester |
Wiley ID |
1283049 |