SpectraBase Spectrum ID |
BoDCPqcdgZk |
Name |
(-)-menthoxyacetyl chloride |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
232.123007614 u |
Formula |
C12H21ClO2 |
InChI |
InChI=1S/C12H21ClO2/c1-8(2)10-5-4-9(3)6-11(10)15-7-12(13)14/h8-11H,4-7H2,1-3H3/t9-,10+,11-/m1/s1 |
InChIKey |
VNMCKLVHDJADEB-OUAUKWLOSA-N |
Molecular Weight |
232.751 g/mol |
SMILES |
[C@]1([C@@](CC[C@](C1)(C)[H])(C(C)C)[H])(OCC(=O)Cl)[H] |
Spectrum/Structure Validation Score (Raman) |
0.982845 |