| SpectraBase Spectrum ID |
3XALGfDFJ5B |
| Name |
(3aS,10aS)-6,7-Dimethyl-3,3a,4,9,10,10a-hexahydro-benzo[b]cyclopenta[e][1,4]diazepine |
| Alternate Name(s) |
(3aS,10aS)-6,7-dimethyl-3,3a,4,9,10,10a-hexahydrocyclopenta[b][1,5]benzodiazepine
cis and trans-7,8-Dimethyl-1,3a,4,5,10,10a-Hexahydrocyclopenta[b][1,5]benzodiazepine |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C14H18N2 |
| InChI |
InChI=1S/C14H18N2/c1-9-6-13-14(7-10(9)2)16-12-5-3-4-11(12)8-15-13/h3-4,6-7,11-12,15-16H,5,8H2,1-2H3/t11-,12-/m0/s1 |
| InChIKey |
GPUIUEXUKSICBL-RYUDHWBXSA-N |
| Molecular Weight |
214.312 g/mol |
| SMILES |
N1[C@@]2([C@](CNc3c1cc(c(C)c3)C)(C=CC2)[H])[H] |
| SPLASH |
splash10-01ot-0960000000-be87e64e72150d8e9d69 |
| Source of Spectrum |
F-51-12391-14 |
| Wiley ID |
794319 |
![(3aS,10aS)-6,7-Dimethyl-3,3a,4,9,10,10a-hexahydro-benzo[b]cyclopenta[e][1,4]diazepine](/api/spectrum/3XALGfDFJ5B/structure.png?h=300&w=458 "(3aS,10aS)-6,7-Dimethyl-3,3a,4,9,10,10a-hexahydro-benzo[b]cyclopenta[e][1,4]diazepine")
