| SpectraBase Spectrum ID |
1Aaj1SEZxRo |
| Name |
4-(N-Benzylaminomethyl)-5-methyl-4',5'-dipentyltetrathiafulvalene |
| Alternate Name(s) |
benzyl({[2-(4,5-dipentyl-2H-1,3-dithiol-2-ylidene)-5-methyl-2H-1,3-dithiol-4-yl]methyl})amine |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C25H35NS4 |
| InChI |
InChI=1S/C25H35NS4/c1-4-6-9-15-21-22(16-10-7-5-2)29-25(28-21)24-27-19(3)23(30-24)18-26-17-20-13-11-8-12-14-20/h8,11-14,26H,4-7,9-10,15-18H2,1-3H3 |
| InChIKey |
PMRLTMCMIGLLCQ-UHFFFAOYSA-N |
| Molecular Weight |
477.802 g/mol |
| SMILES |
N(CC=1SC(=C2SC(CCCCC)=C(S2)CCCCC)SC1C)Cc1ccccc1 |
| SPLASH |
splash10-00i0-0009900000-da7fd15164aac35dfa7a |
| Source of Spectrum |
QF-8-4667-12 |
| Wiley ID |
1558013 |
