Spectrum FiehnLib000356 for fucose

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Compound Information

Chemical Names

Compound Classification (provided by ClassyFire)

ClassyFire is a freely accessible computational tool that uses the ChemOnt taxonomy to classify chemical entities based on their structure. ClassyFire combines structure search, IUPAC name parsing, and evaluation of logical expressions to retrieve structural features, which are then mapped to the corresponding ChemOnt classes.

Compound Metadata

NameValue
17106
InChI=1S/C6H12O5/c1-2-3(7)4(8)5(9)6(10)11-2/h2-10H,1H3/t2-,3+,4+,5-,6?/m0/s1
SHZGCJCMOBCMKK-DHVFOXMCSA-N
C6H12O5
164.06847348399998
OC1OC(C)C(O)C(O)C1O

Mass Spectral Metadata

NameValue
060125bylqc05
584581
peak 2
4 TMS; 1 MEOX
481.253
MS1
Leco Pegasus IV
GC-EI-TOF
250C
230C
-70 eV
80-500 Da
10m
Restek Corporation Rtx-5Sil MS (30 m length x 0.25 mm internal diameter with 0.25 µm film made of 95% dimethyl/5%diphenylpolysiloxane)
helium
50-330°C
1 mL min-1
0.5 µL
25 splitless time into a multi-baffled glass liner
50°C ramped to 250°C by 12°C s-1
50°C for 1 min, then ramped at 20°C min-1 to 330°C, held constant for 5 min.
1800 V
positive
2.594978340214354
0.6048252817231569