| SpectraBase Spectrum ID |
7a8CLBoXwGN |
| Name |
(R)-1-((Allyloxycarbonyl)formylamino)-2-chloro-1-phenylethane |
| Appearance |
Pale yellow oil |
| Carrier Gas |
Nitrogen |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
267.066221012 u |
| Formula |
C13H14ClNO3 |
| GC Column |
CP-Chirasil-DX CB or FS Supreme-5 MS (25 m x 0.25 mm, film thickness 0.25 micrometer) |
| InChI |
InChI=1S/C13H14ClNO3/c1-2-8-18-13(17)15(10-16)12(9-14)11-6-4-3-5-7-11/h2-7,10,12H,1,8-9H2/t12-/m0/s1 |
| InChIKey |
ABJNLSQEPBCCFF-LBPRGKRZSA-N |
| Instrument Name |
Shimadzu GCMS-QP2010 Plus |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.201800588 |
| Molecular Weight |
267.712 g/mol |
| Optical Rotation |
[a]D20 = -36.2 (c = 1.35 g/100 mL, CHCl3) |
| Quality |
331 |
| Reported Formula |
C13H14(35)ClNO3 |
| SMILES |
C1=C(C=CC=C1)[C@@](N(C(=O)OCC=C)C=O)(CCl)[H] |
| SPLASH |
splash10-0w2c-5900000000-461e9cd3206e7f1b9eca |
| Source of Spectrum |
QE-24-SM78-10(26) (DOI: 10.1002/chem.201800588) |
| Thin-Layer Chromatography |
0.61 (SiO2, Et2O/toluene, 4:96) |
| Wiley ID |
1901462 |
