| SpectraBase Spectrum ID |
5rbD28r19ZK |
| Name |
(2S)-2-(Tert-butoxycarbonylamino)-3-[4-(3-methylbut-2-enyl)-1H-indol-3-yl]propionic acid methyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
386.220557450 u |
| Formula |
C22H30N2O4 |
| InChI |
InChI=1S/C22H30N2O4/c1-14(2)10-11-15-8-7-9-17-19(15)16(13-23-17)12-18(20(25)27-6)24-21(26)28-22(3,4)5/h7-10,13,18,23H,11-12H2,1-6H3,(H,24,26)/t18-/m0/s1 |
| InChIKey |
YVQOGAFAJMQYBP-SFHVURJKSA-N |
| Molecular Weight |
386.492 g/mol |
| SMILES |
C1(=CNC=2C1=C(CC=C(C)C)C=CC2)C[C@](NC(OC(C)(C)C)=O)(C(=O)OC)[H] |
![(2S)-2-(tert-butoxycarbonylamino)-3-[4-(3-methylbut-2-enyl)-1H-indol-3-yl]propionic acid methyl ester](/api/spectrum/5rbD28r19ZK/structure.png?h=300&w=458 "(2S)-2-(tert-butoxycarbonylamino)-3-[4-(3-methylbut-2-enyl)-1H-indol-3-yl]propionic acid methyl ester")
