SpectraBase Compound ID | 4YRjNLiVTjS |
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InChI | InChI=1S/C10H16/c1-7-4-5-8-9(6-7)10(8,2)3/h4-5,7-9H,6H2,1-3H3 |
InChIKey | LGNSZMLHOYDATP-UHFFFAOYSA-N |
Mol Weight | 136.24 g/mol |
Molecular Formula | C10H16 |
Exact Mass | 136.125201 g/mol |
SpectraBase Spectrum ID | 1RMnCceEXe0 |
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Name | 4-Carene, (1S,3R,6R)-(-)- |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 136.125200515 u |
Formula | C10H16 |
InChI | InChI=1S/C10H16/c1-7-4-5-8-9(6-7)10(8,2)3/h4-5,7-9H,6H2,1-3H3 |
InChIKey | LGNSZMLHOYDATP-UHFFFAOYSA-N |
Molecular Weight | 136.238 g/mol |
SMILES | CC1(C)C2C=CC(CC12)C |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.975429 |