| SpectraBase Spectrum ID |
BD52nadvCX5 |
| Name |
(2E,5R)-2-cyano-5,9-dimethyl-deca-2,8-dienoic acid methyl ester |
| Alternate Name(s) |
methyl (2E,5R)-2-cyano-5,9-dimethyl-deca-2,8-dienoate
(2E,5R)-2-cyano-5,9-dimethyldeca-2,8-dienoic acid methyl ester |
| CAS Registry Number |
120229-89-2 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C14H21NO2 |
| InChI |
InChI=1S/C14H21NO2/c1-11(2)6-5-7-12(3)8-9-13(10-15)14(16)17-4/h6,9,12H,5,7-8H2,1-4H3/b13-9+/t12-/m1/s1 |
| InChIKey |
OBWAVKMQJUKRLF-AUWXEVLLSA-N |
| Molecular Weight |
235.327 g/mol |
| SMILES |
C(\C(C#N)=C\C[C@@](CCC=C(C)C)(C)[H])(=O)OC |
| SPLASH |
splash10-0079-0090000000-eac90f35ffa7fd16fe8e |
| Source of Spectrum |
J-54-3126-9 |
| Wiley ID |
1237220 |
