Dataset

patchouli alcohol.noesy

Chemical Info

molecular Image
InChI InChI=1S/C15H26O/c1-10-5-8-15(16)13(2,3)11-6-7-14(15,4)12(10)9-11/h10-12,16H,5-9H2,1-4H3/t10-,11-,12-,14+,15-/m0/s1
SMILES C[C@H]1CC[C@]2(O)C(C)(C)[C@H]3CC[C@]2(C)[C@H]1C3
InChI Key GGHMUJBZYLPWFD-JVSQWTDWSA-N
Molecular Formula C15H26O
Exact Mass 222.370 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.57992/nmrxiv.p42.s247.d1434
License URL https://creativecommons.org/licenses/by/4.0/legalcode
Source https://nmrxiv.org/D1434
Version
Author Peter Spiteller
Maintainer
Language english
MetadataCreated 2024-04-22T16:21:59.770665
MetadataModified 2024-09-23T09:33:21.024946
MetadataPublished 2023-12-24 21:57:47
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