Vitas-M small molecule compound

1,5,5-trimethyl-1,2,4,5-tetrahydrospiro[2-benzazepine-3,1'-cyclohexane]

Catalog ID
STK893578
SMILES CC1NC2(CCCCC2)CC(c2c1cccc2)(C)C

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C18H27N MW 257.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H27N/c1-14-15-9-5-6-10-16(15)17(2,3)13-18(19-14)11-7-4-8-12-18/h5-6,9-10,14,19H,4,7-8,11-13H2,1-3H3
InChIKey
DHJGTZXBHHFZQG-UHFFFAOYSA-N
Synonyms

155trimethyl1245tetrahydrospiro(2benzazepine31cyclohexane)
155trimethyl1245tetrahydrospiro(benzo(c)azepine31cyclohexane)oxalate
155TRIMETHYLSPIRO(24DIHYDRO1H2BENZAZEPINE31CYCLOHEXANE)
CC1C2=CC=CC=C2C(CC3(N1)CCCCC3)(C)C
InChI=1SC18H27Nc114159561016(15)17(23)1318(1914)117481218h569101419H4781113H213H3
MFCD01895574
OC(=O)C(=O)OCC1NC2(CCCCC2)CC(c2c1cccc2)(C)C
ZINC000001322337
ZINC000001322338

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.