SpectraBase Spectrum ID |
IPg6mmGXXZr |
Name |
1,4-Methanonaphthalene-2-carboxylic acid, 1,2,3,4-tetrahydro-2-methyl-, (1.alpha.,2.alpha.,4.alpha.)- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
202.099379689 u |
Formula |
C13H14O2 |
InChI |
InChI=1S/C13H14O2/c1-13(12(14)15)7-8-6-11(13)10-5-3-2-4-9(8)10/h2-5,8,11H,6-7H2,1H3,(H,14,15)/t8-,11-,13+/m1/s1 |
InChIKey |
FOLIQBLLTZDYMV-DYLAAIIWSA-N |
Molecular Weight |
202.253 g/mol |
SMILES |
[C@@]1([C@]2(C3=CC=CC=C3[C@@](C1)(C2)[H])[H])(C(=O)O)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.968155 |