SpectraBase Spectrum ID |
MSqmr6g9UD |
Name |
cis,exo-1,2,3,4,4a,13b-Hexahydro-1,4-methano-6-chloro-9H-tribenzo[b,f]azepine |
Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C19H18ClN |
InChI |
InChI=1S/C19H18ClN/c20-13-7-8-17-15(10-13)19-12-6-5-11(9-12)18(19)14-3-1-2-4-16(14)21-17/h1-4,7-8,10-12,18-19,21H,5-6,9H2/t11-,12+,18-,19+/m1/s1 |
InChIKey |
NRTCMBUSCYKCBP-NEYQJUBMSA-N |
Molecular Weight |
295.813 g/mol |
SMILES |
N1c2c([C@]3([C@@]4(CC[C@]([C@]3(c3c1ccc(c3)Cl)[H])(C4)[H])[H])[H])cccc2 |
SPLASH |
splash10-01r2-0090000000-534810921d16ba46ae06 |
Source of Spectrum |
CCC-10-SM8-3d |
Synonyms |
(1R,4S,4aR,13bS)-6-chloro-2,3,4,4a,9,13b-hexahydro-1H-1,4-methanotribenzo[b,d,f]azepine |
Wiley ID |
1812690 |