SpectraBase Spectrum ID |
JWIS4TBWSE9 |
Name |
3-[5-[[1-(tert-Butoxycarbonyl)-2(S)-azetidinyl]methoxy]-3-pyridyl]-3-azabicyclo[3.1.0]hexane |
Appearance |
Colorless oil |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C19H27N3O3 |
InChI |
InChI=1S/C19H27N3O3/c1-19(2,3)25-18(23)22-5-4-15(22)12-24-17-7-16(8-20-9-17)21-10-13-6-14(13)11-21/h7-9,13-15H,4-6,10-12H2,1-3H3/t13?,14?,15-/m0/s1 |
InChIKey |
PDTRUHINRSKQOA-NRXISQOPSA-N |
Ionization Type |
EI |
Molecular Weight |
345.443 g/mol |
Optical Rotation |
[a]D589 = -64.5 (c = 8.30 g/L, EtOAc) |
SMILES |
c1(OC[C@@]2(CCN2C(OC(C)(C)C)=O)[H])cncc(N2CC3C(C2)C3)c1 |
SPLASH |
splash10-056u-9711000000-16eae764b7345955aac6 |
Source of Spectrum |
US20100152450A1 |
Wiley ID |
1842420 |