Dataset

Myrcene 60/400/900 MHz in CDCl3 NMR data.hsqc

NMR data for myrcene contains: 1H NMR acquired at 60 MHz, as well as 1D: 1H,13C 2D: COSY, HSQC and HMBC acquired 400 MHz (Jeol 400 MHz spectrometer with SuperCOOL Probe), as well as 1D: 1H 2D: COSY acquired 900 MHz (Bruker AVANCE NMR, 5mm TCI cryogenic probe) in CDCl3 (2019-10-07)

https://doi.org/10.7910/DVN/BBYECY, Harvard Dataverse, V2

Chemical Info

InChI	InChI=1S/C10H16/c1-5-10(4)8-6-7-9(2)3/h5,7H,1,4,6,8H2,2-3H3
SMILES	C=CC(=C)CCC=C(C)C
InChI Key	UAHWPYUMFXYFJY-UHFFFAOYSA-N
Molecular Formula	C10H16
Exact Mass	136.230 g/mol

Data and Resources

Myrcene 60/400/900 MHz in CDCl3 NMR data.hsqcHTML
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Metadata Information

Field	Value
DOI	10.57992/nmrxiv.p33.s217.d1191
License URL	https://creativecommons.org/publicdomain/zero/1.0/legalcode
Source	https://nmrxiv.org/D1191
Version
Author	Bisson J, McAlpine JB, Friesen JB, Chen SN, Graham J, Pauli GF.
Maintainer
Language	english
MetadataCreated	2024-04-22T17:03:22.904616
MetadataModified	2024-04-22T17:03:22.904621
MetadataPublished	2023-12-21 14:26:13

Field	Value
Measurement Technique	heteronuclear single quantum coherence
Measurement Variables	acquisition nucleus : 13C , 1H Temperature : K magnetic field strength : Tesla number of scans : scans number of data points : points relaxation time measurement : seconds