SpectraBase Spectrum ID |
2kdjahS12iC |
Name |
tert-Butyl[-3-[5-[(2(S)-Azetidinyl)methoxy]-3-pyridyl]benzyl]carbamate |
Appearance |
Colorless film |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C21H27N3O3 |
InChI |
InChI=1S/C21H27N3O3/c1-21(2,3)27-20(25)24-11-15-5-4-6-16(9-15)17-10-19(13-22-12-17)26-14-18-7-8-23-18/h4-6,9-10,12-13,18,23H,7-8,11,14H2,1-3H3,(H,24,25)/t18-/m0/s1 |
InChIKey |
CFGRRECFFVOYAD-SFHVURJKSA-N |
Ionization Type |
EI |
Molecular Weight |
369.465 g/mol |
Optical Rotation |
[a]D546 = 0 (c = 6.4 g/L, MeOH) |
SMILES |
N1[C@](COc2cncc(-c3cc(CNC(OC(C)(C)C)=O)ccc3)c2)(CC1)[H] |
SPLASH |
splash10-0bt9-9042000000-eec722516f4db912f01a |
Source of Spectrum |
US20100152450A1 |
Wiley ID |
1842425 |