cis-Rose oxide

Formula: C₁₀H₁₈O
Molecular weight: 154.2493
IUPAC Standard InChI: InChI=1S/C10H18O/c1-8(2)6-10-7-9(3)4-5-11-10/h6,9-10H,4-5,7H2,1-3H3
IUPAC Standard InChIKey: CZCBTSFUTPZVKJ-UHFFFAOYSA-N
CAS Registry Number: 876-17-5
Chemical structure:
This structure is also available as a 2d Mol file
Stereoisomers:
Other names: (Z)-Rose oxide; (+)-cis-rose oxide; (-)-cis-rose oxide; c-rose oxide; Rose oxide, cis; 2H-Pyran, tetrahydro-4-methyl-2-(2-methyl-1-propenyl)-, (2R,4S)-rel-
Permanent link for this species. Use this link for bookmarking this species for future reference.
Information on this page:
Other data available:
- Gas Chromatography
Options:
- Switch to calorie-based units

Normal alkane RI, polar column, custom temperature program

Data compiled by: NIST Mass Spectrometry Data Center, William E. Wallace, director

Column type	Capillary	Capillary	Capillary	Capillary	Capillary
Active phase	CP-Wax 52 CB	Carbowax 20M	Innowax FSC	Carbowax 20M	Carbowax 20M
Column length (m)	50.		60.
Carrier gas	Helium		He
Substrate
Column diameter (mm)	0.25		0.25
Phase thickness (μm)	0.29		0.25
Program	33 0C (1 min) 2 0C/min -> 130 0C 10 0C/min -> 220 0C	not specified	60C(10min) => 4C/min => 220C(10min) => 1C/min => 240C	not specified	not specified
I	1331.	1358.	1362.	1354.	1354.
Reference	Kaack and Christensen, 2008	Editorial paper, 2005	Baser, Özek, et al., 2004	Vinogradov, 2004	Vinogradov, 2004
Comment	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI	MSDC-RI

Column type	Capillary	Capillary	Capillary
Active phase	DB-Wax	DB-FFAP	DB-FFAP
Column length (m)	60.	30.	30.
Carrier gas	N2
Substrate
Column diameter (mm)		0.32	0.32
Phase thickness (μm)	0.25	0.25	0.25
Program	not specified	35C (1min) => 40C/min => 60C (1min) => 6C/min => 250C (10min)	35C (1min) => 40C/min => 60C (1min) => 6C/min => 250C (10min)
I	1364.	1337.	1337.
Reference	Weyerstahl, Marschall, et al., 1998	Guth, 1997	Guth, 1997
Comment	MSDC-RI	MSDC-RI	MSDC-RI

References

Go To: Top, Normal alkane RI, polar column, custom temperature program, Notes

Kaack and Christensen, 2008
Kaack, K.; Christensen, L.P., Effect of packing materials and storage time on volatile compounds in tea processes from flowers of black elder (Sambucus nigra L.), Eur. Food Res. Technol., 2008, 227, 4, 1259-1273, https://doi.org/10.1007/s00217-008-0844-8 . [all data]

Editorial paper, 2005
Editorial paper, Solid Phase Microextraction (SPME) Application Guide, The Reporter Europe (Supelco), 2005, 16, 5, 12-12. [all data]

Baser, Özek, et al., 2004
Baser, K.H.C.; Özek, T.; Kirimer, N.; Deliorman, D.; Ergun, F., Composition of the essential oils of Galium aparine L. and Galium odoratum (L.) Scop. from Turkey, J. Essent. Oil Res., 2004, 16, 4, 305-307, https://doi.org/10.1080/10412905.2004.9698728 . [all data]

Vinogradov, 2004
Vinogradov, B.A., Production, composition, properties and application of essential oils, 2004, retrieved from http://viness.narod.ru. [all data]

Weyerstahl, Marschall, et al., 1998
Weyerstahl, P.; Marschall, H.; Weirauch, M.; Thefeld, K.; Surburg, H., Constituents of commercial Labdanum oil, Flavour Fragr. J., 1998, 13, 5, 295-318, https://doi.org/10.1002/(SICI)1099-1026(1998090)13:5<295::AID-FFJ751>3.0.CO;2-I . [all data]

Guth, 1997
Guth, H., Identification of character impact odorants of different white wine varieties, J. Agric. Food Chem., 1997, 45, 8, 3022-3026, https://doi.org/10.1021/jf9608433 . [all data]

Notes

Go To: Top, Normal alkane RI, polar column, custom temperature program, References

Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
The National Institute of Standards and Technology (NIST) uses its best efforts to deliver a high quality copy of the Database and to verify that the data contained therein have been selected on the basis of sound scientific judgment. However, NIST makes no warranties to that effect, and NIST shall not be liable for any damage that may result from errors or omissions in the Database.
Customer support for NIST Standard Reference Data products.