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PHL83351

α-Humulene

phyproof® Reference Substance

Synonym(s):

α-Caryophyllene, trans,trans,trans-2,6,6,9-Tetramethyl-1,4,8-cycloundecatriene

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About This Item

Empirical Formula (Hill Notation):
C15H24
CAS Number:
6753-98-6
Molecular Weight:
204.35
NACRES:
NA.24
UNSPSC Code:
41116107
Beilstein/REAXYS Number:
3240075
MDL number:
MFCD00042689
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grade

primary reference standard

product line

phyproof® Reference Substance

assay

≥90.0% (GC)

form

liquid

manufacturer/tradename

PhytoLab

refractive index

n20/D 1.503 (lit.)

bp

166-168 °C (lit.)

density

0.889 g/mL at 20 °C (lit.)

storage temp.

−20°C

SMILES string

C\C1=C/CC(C)(C)\C=C\C\C(C)=C\CC1

InChI

1S/C15H24/c1-13-7-5-8-14(2)10-12-15(3,4)11-6-9-13/h6-7,10-11H,5,8-9,12H2,1-4H3/b11-6+,13-7+,14-10+

InChI key

FAMPSKZZVDUYOS-HRGUGZIWSA-N

General description

This substance is a primary reference substance with assigned absolute purity (considering chromatographic purity, water, residual solvents, inorganic impurities). The exact value can be found on the certificate. Produced by PhytoLab GmbH & Co. KG

Other Notes

This compound is commonly found in plants of the genus: angelica salvia

Legal Information

phyproof is a registered trademark of PhytoLab GmbH & Co. KG

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pictograms

Exclamation mark
GHS07

signalword

Warning

Hazard Classifications

Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

target_organs

Respiratory system

Storage Class

10 - Combustible liquids

wgk

WGK 3

flash_point_f

194.0 °F - closed cup

flash_point_c

90 °C - closed cup

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Certificates of Analysis (COA)

Lot/Batch Number
330891
325053
297785
283963
307815

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Articles

Analysis of Volatiles in Perilla Using SPME Fibers

A throughput HS-SPME-GC-MS method to analyze volatile compounds in Perilla leaves at low extraction temperatures using four different SPME fibers.