| SpectraBase Spectrum ID |
7dhT7nJhRuK |
| Name |
Methyl-N-{[2,5-bis-(butylthio)-3,4-dihydro-2H-pyran-2-yl]methylen}phenyl-alaninate |
| Appearance |
Dark brown oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C24H35NO3S2 |
| InChI |
InChI=1S/C24H35NO3S2/c1-4-6-15-29-21-13-14-24(28-18-21,30-16-7-5-2)19-25-22(23(26)27-3)17-20-11-9-8-10-12-20/h8-12,18-19,22H,4-7,13-17H2,1-3H3 |
| InChIKey |
IPHJLTDDHHGCCX-UHFFFAOYSA-N |
| Instrument Name |
Shimadzu GCMS QP 5050A |
| Ionization Type |
EI |
| Literature Reference DOI |
10.24820/ark.5550190.p011.567 |
| Molecular Weight |
449.668 g/mol |
| SMILES |
C1(SCCCC)(C=NC(Cc2ccccc2)C(=O)OC)OC=C(CC1)SCCCC |
| SPLASH |
splash10-03dl-5139000000-561f805c1b1e02b102b1 |
| Sample Comments |
dr = 1.3:1 |
| Source of Spectrum |
ARK-2021-336-3f |
| Wiley ID |
1873151 |
![Methyl-N-{[2,5-bis-(butylthio)-3,4-dihydro-2H-pyran-2-yl]methylen}phenyl-alaninate](/api/spectrum/7dhT7nJhRuK/structure.png?h=300&w=458 "Methyl-N-{[2,5-bis-(butylthio)-3,4-dihydro-2H-pyran-2-yl]methylen}phenyl-alaninate")
