SpectraBase Spectrum ID |
Ad4eR8Mn9xY |
Name |
Cyclopropanecarboxylic acid, 1-chloro-2-methyl-3-phenyl-, (1.alpha.,2.alpha.,3.alpha.)- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
210.044757292 u |
Formula |
C11H11ClO2 |
InChI |
InChI=1S/C11H11ClO2/c1-7-9(11(7,12)10(13)14)8-5-3-2-4-6-8/h2-7,9H,1H3,(H,13,14)/t7-,9-,11+/m1/s1 |
InChIKey |
GCEFOAHVWRZSLT-ZOFUNIGCSA-N |
Molecular Weight |
210.660 g/mol |
SMILES |
[C@]1([C@@](C=2C=CC=CC2)([C@]1(C)[H])[H])(C(=O)O)Cl |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.882657 |