| SpectraBase Spectrum ID |
BWq611tvi0a |
| Name |
(S)-tert-Butyl {2-[1-Benzyl-2-(1-(4-methoxyphenyl)ethyl)-1H-indol-3-yl]ethyl}carbamate |
| Appearance |
Colorless solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
484.272593024 u |
| Formula |
C31H36N2O3 |
| InChI |
InChI=1S/C31H36N2O3/c1-22(24-15-17-25(35-5)18-16-24)29-27(19-20-32-30(34)36-31(2,3)4)26-13-9-10-14-28(26)33(29)21-23-11-7-6-8-12-23/h6-18,22H,19-21H2,1-5H3,(H,32,34)/t22-/m0/s1 |
| InChIKey |
IVBKPUFPXPXWTG-QFIPXVFZSA-N |
| Instrument Name |
Jeol AccuTOF |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.201709075 |
| Molecular Weight |
484.640 g/mol |
| Optical Rotation |
[a]D23 = -53.5 (c = 0.23, CHCl3) |
| Quality |
22 |
| Reported Formula |
C31H36N2O3 |
| SMILES |
N(CCC1=C(N(C2=C1C=CC=C2)CC1=CC=CC=C1)[C@@](C)(C=1C=CC(=CC1)OC)[H])C(OC(C)(C)C)=O |
| SPLASH |
splash10-0udl-8019000000-df7a52c67c8e10b487c8 |
| Sample Comments |
er = 12:88 |
| Source of Spectrum |
ACI-56-SM126-S-6 (DOI: 10.1002/anie.201709075) |
| Wiley ID |
1896505 |
![(S)-tert-Butyl {2-[1-Benzyl-2-(1-(4-methoxyphenyl)ethyl)-1H-indol-3-yl]ethyl}carbamate](/api/spectrum/BWq611tvi0a/structure.png?h=300&w=458 "(S)-tert-Butyl {2-[1-Benzyl-2-(1-(4-methoxyphenyl)ethyl)-1H-indol-3-yl]ethyl}carbamate")
