SpectraBase Spectrum ID |
2jmCdzlOFSn |
Name |
Carbamic acid, N-(3-iodopropyl)-, 1,1-dimethylethyl ester |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
285.022573757 u |
Formula |
C8H16INO2 |
InChI |
InChI=1S/C8H16INO2/c1-8(2,3)12-7(11)10-6-4-5-9/h4-6H2,1-3H3,(H,10,11) |
InChIKey |
ORVXNBKOWDNMGB-UHFFFAOYSA-N |
Molecular Weight |
285.125 g/mol |
SMILES |
C(I)CCNC(=O)OC(C)(C)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.890011 |