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Product Information
Chemical Data
Analyte Name
3-(1-Azepanyl)-1-propanamine
CAS Number
3437-33-0
Molecular Formula
C21 H28 O2
Molecular Weight
312.446
Accurate Mass
312.209
SMILES
CC[C@]12CC[C@@H]3[C@@H](CCC4=CC(=O)CC[C@H]34)[C@H]1CC[C@]2(O)C#C
InChI
InChI=1S/C21H28O2/c1-3-20-11-9-17-16-8-6-15(22)13-14(16)5-7-18(17)19(20)10-12-21(20,23)4-2/h2,13,16-19,23H,3,5-12H2,1H3/t16-,17-,18+,19+,20-,21+/m0/s1
IUPAC
(8R,9R,10R,13S,14R,17S)-13-ethyl-17-ethynyl-17-hydroxy-1,2,6,7,8,9,10,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-one
Product Data
Storage Temperature
+4°C
Shipping Temperature
Room Temperature
Country of Origin
CANADA
Product Format
Neat
Purity
>95% (HPLC)