| SpectraBase Spectrum ID |
95PBtS4ICUz |
| Name |
1H-Azepine, 1-butylhexahydro-3-(2-pyridinylthio)-, (.+-.)- |
| CAS Registry Number |
129885-62-7 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C15H24N2S |
| InChI |
InChI=1S/C15H24N2S/c1-2-3-11-17-12-7-5-8-14(13-17)18-15-9-4-6-10-16-15/h4,6,9-10,14H,2-3,5,7-8,11-13H2,1H3 |
| InChIKey |
CVEIHDNNJIJWKO-UHFFFAOYSA-N |
| Molecular Weight |
264.431 g/mol |
| SMILES |
C1N(CCCCC1Sc1ncccc1)CCCC |
| SPLASH |
splash10-03di-0900000000-3810492561ccc1968edd |
| Source of Spectrum |
F-46-2343-38 |
| Synonyms |
1-aza-n-butyl-3-pyridylthiocycloheptane
1-butyl-3-(2-pyridinylsulfanyl)hexahydro-1H-azepine
1-butylhexahydro-1H-azepin-3-yl 2-pyridinyl sulfide |
| Wiley ID |
1268096 |
