SpectraBase Compound ID | 6EiBU44QoPp |
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InChI | InChI=1S/C10H16O2/c1-10(2)7-4-3-6(5-7)8(10)9(11)12/h6-8H,3-5H2,1-2H3,(H,11,12)/t6-,7+,8+/m1/s1 InChI=1S/C10H16O2/c1-10(2)7-4-3-6(5-7)8(10)9(11)12/h6-8H,3-5H2,1-2H3,(H,11,12)/t6-,7+,8+/m0/s1 |
InChIKey | KJKODDSNIDHCKV-CSMHCCOUSA-N |
Mol Weight | 168.24 g/mol |
Molecular Formula | C10H16O2 |
Exact Mass | 168.11503 g/mol |
SpectraBase Spectrum ID | 55CACMWTAqr |
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Name | Endo-3,3-dimethyl-2-norbornanecarboxylic acid |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 168.115029753 u |
Formula | C10H16O2 |
InChI | InChI=1S/C10H16O2/c1-10(2)7-4-3-6(5-7)8(10)9(11)12/h6-8H,3-5H2,1-2H3,(H,11,12)/t6-,7+,8+/m1/s1 |
InChIKey | KJKODDSNIDHCKV-CSMHCCOUSA-N |
Molecular Weight | 168.236 g/mol |
SMILES | OC([C@]1(C([C@]2(CC[C@@]1(C2)[H])[H])(C)C)[H])=O |
Spectrum/Structure Validation Score (Raman) | 0.92947 |