| SpectraBase Spectrum ID |
965KYjwYGUM |
| Name |
1,4-Cyclohexadiene-1-butanol, 2-methoxy-.delta.,4-dimethyl-, 3,5-dinitrobenzoate |
| CAS Registry Number |
63646-87-7 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H24N2O7 |
| InChI |
InChI=1S/C20H24N2O7/c1-13-6-7-18(19(9-13)28-3)14(2)5-4-8-29-20(23)15-10-16(21(24)25)12-17(11-15)22(26)27/h6,10-12,14H,4-5,7-9H2,1-3H3 |
| InChIKey |
GXFJVMMSARGTRB-UHFFFAOYSA-N |
| Molecular Weight |
404.419 g/mol |
| SMILES |
c1(N(=O)=O)cc(N(=O)=O)cc(c1)C(=O)OCCCC(C1=C(CC(=CC1)C)OC)C |
| SPLASH |
splash10-00di-1900000000-d3d3965136a91c2e53d5 |
| Source of Spectrum |
H-60-971-0 |
| Synonyms |
3,5-Dinitrobenzoate of 4-(2'-methoxy-4'-methylcyclohexa-1',4'-dien-1'-yl)pentan-1-ol
4-(2-Methoxy-4-methyl-1,4-cyclohexadien-1-yl)pentyl 3,5-dinitrobenzoate |
| Wiley ID |
1371163 |
