| SpectraBase Spectrum ID |
HY4mb9c74ik |
| Name |
(Phenylmethyl) N-[(1S,2S)-1-chloranyl-1-phenyl-propan-2-yl]carbamate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
303.102606522 u |
| Formula |
C17H18ClNO2 |
| InChI |
InChI=1S/C17H18ClNO2/c1-13(16(18)15-10-6-3-7-11-15)19-17(20)21-12-14-8-4-2-5-9-14/h2-11,13,16H,12H2,1H3,(H,19,20)/t13-,16+/m0/s1 |
| InChIKey |
IFZCGGIJBLUSQR-XJKSGUPXSA-N |
| Molecular Weight |
303.789 g/mol |
| SMILES |
C(N[C@]([C@](C=1C=CC=CC1)(Cl)[H])(C)[H])(=O)OCC=1C=CC=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.928172 |
![(phenylmethyl) N-[(1S,2S)-1-chloranyl-1-phenyl-propan-2-yl]carbamate](/api/spectrum/HY4mb9c74ik/structure.png?h=300&w=458 "(phenylmethyl) N-[(1S,2S)-1-chloranyl-1-phenyl-propan-2-yl]carbamate")
