1,3-Benzodioxole, 4-methoxy-6-(2-propenyl)-
- Formula: C11H12O3
- Molecular weight: 192.2112
- IUPAC Standard InChIKey: BNWJOHGLIBDBOB-UHFFFAOYSA-N
- CAS Registry Number: 607-91-0
- Chemical structure:
This structure is also available as a 2d Mol file - Other names: Benzene, 5-allyl-1-methoxy-2,3-(methylenedioxy)-; Myristicin; 5-Allyl-1-methoxy-2,3-(methylenedioxy)benzene; 6-Allyl-4-methoxy-1,3-benzodioxole; Myristicine; 4-Methoxy-6-(2-propenyl)-1,3-benzodioxole; 1,3-Benzodioxole, 4-methoxy-6-(1-propenyl)-
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Normal alkane RI, non-polar column, custom temperature program
Go To: Top, References, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Data compiled by: NIST Mass Spectrometry Data Center, William E. Wallace, director
Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
---|---|---|---|---|---|
Active phase | HP-5 MS | DB-5 | HP-5 MS | DB-1 | OV-1 |
Column length (m) | 30. | 30. | 30. | 30. | 30. |
Carrier gas | Helium | Hydrogen | Helium | Helium | Helium |
Substrate | |||||
Column diameter (mm) | 0.25 | 0.25 | 0.25 | 0.25 | 0.25 |
Phase thickness (μm) | 0.25 | 0.25 | 0.25 | 0.25 | |
Program | 50 0C (1.5 min) 10 0C/min -> 180 0C (2 min) 6 0C/min -> 280 0C (10 min) | 35 0C (2 min) 4 0C/min -> 180 0C 20 0C/min -> 280 0C | 50 0C (3 min) 3 0C/min -> 160 0C (10 min) 3 0C/min -> 240 0C | not specified | 40 0C 2 0C/min -> 120 0C 10 0C/min -> 230 0C (15 min) |
I | 1529. | 1515. | 1491. | 1526. | 1483. |
Reference | Wang, Xu, et al., 2011 | Pontes, Silva, et al., 2010 | Sharifiar, Yassa, et al., 2010 | Xu, Tang, et al., 2010 | Li, Liang, et al., 2009 |
Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
---|---|---|---|---|---|
Active phase | DB-1 | DB-5 | RTX-5 | RTX-5 | DB-5 |
Column length (m) | 30. | 25. | 30. | 30. | 50. |
Carrier gas | Hydrogen | Nitrogen | Helium | Helium | Helium |
Substrate | |||||
Column diameter (mm) | 0.25 | 0.22 | 0.25 | 0.25 | 0.32 |
Phase thickness (μm) | 0.25 | 0.25 | 0.25 | 0.25 | 0.25 |
Program | 45 0C 3 0C/min -> 175 0C 15 0C/min -> 300 0C (10 min) | not specified | 60 0C (5 min) 5 0C/min -> 110 0C 3 0C/min -> 220 0C (5 min) | not specified | 60 0C (1 min) 5 0C/min -> 160 0C 10 0C/min -> 250 0C |
I | 1493. | 1532. | 1526. | 1519. | 1519. |
Reference | Mendes, Trindade, et al., 2009 | Chieng, Assim, et al., 2008 | Zachariah, Leela, et al., 2008 | Zachariah, Leela, et al., 2008 | Nivinsliene, Butkiene, et al., 2007 |
Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
---|---|---|---|---|---|
Active phase | HP-5 MS | HP-5MS | HP-5MS | DB-1 | DB-1 |
Column length (m) | 30. | 30. | 30. | 30. | 30. |
Carrier gas | Helium | He | He | H2 | He |
Substrate | |||||
Column diameter (mm) | 0.25 | 0.25 | 0.25 | 0.25 | 0.25 |
Phase thickness (μm) | 0.25 | 0.25 | 0.25 | 0.25 | 0.25 |
Program | not specified | 60C => 1.5C/min => 185C(1min) => 9C/min => 275C(2min) | 40C (10min) => 3C/min => 120C => 10C/min => 250C (5min) | 40 0C 3 K/min -> 175 0C 15 K/min -> 240 0C (10 min) | 45C => 3C/min => 170C => 15C/min => 300C(10min) |
I | 1511. | 1520. | 1528. | 1493. | 1493. |
Reference | Sharififar, Mozaffarian, et al., 2007 | Singh, Marimuthu, et al., 2006 | Ansorena, Gimeno, et al., 2001 | Dorman, Figueiredo, et al., 2000 | Pedro, da Silva, et al., 1999 |
Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
Column type | Capillary | Capillary | Capillary |
---|---|---|---|
Active phase | DB-1 | RTX-5 | DB-1 |
Column length (m) | 30. | 30. | 30. |
Carrier gas | He | He | H2 |
Substrate | |||
Column diameter (mm) | 0.25 | 0.53 | 0.25 |
Phase thickness (μm) | 0.25 | 1.5 | 0.25 |
Program | 45C => 3C/min => 175C => 15C/min => 300C(10min) | 35 0C (2 min) 40 0C/min -> 60 0C (1 min) 6 0C/min -> 230 0C | 45C => 3C/min => 175C => 15C/min => 240C(10min) |
I | 1493. | 1533. | 1493. |
Reference | Santos, Figueiredo, et al., 1999 | Masanetz and Grosch, 1998 | Figueiredo, Barroso, et al., 1997 |
Comment | MSDC-RI | MSDC-RI | MSDC-RI |
References
Go To: Top, Normal alkane RI, non-polar column, custom temperature program, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Wang, Xu, et al., 2011
Wang, J.; Xu, L.; Yang, L.; Liu, Z.; Zhou, L.,
Composition, antibacterial and antioxidant activities of essential oils from Ligusticum sinense and L. jaholense (Unvelliferae) from China,
Rec. Nat. Prod., 2011, 5, 4, 314-318. [all data]
Pontes, Silva, et al., 2010
Pontes, W.J.T.; Silva, J.M.O.; ds Camara, C.A.G.; Gondim-Junior, M.G.C.; Oliveira, J.V.,
Chemical composition and acaricidal activity of the essential oils from fruits and leaves of Protium bahianum Daly,
J. Essential Oil Res., 2010, 22, 3, 279-282, https://doi.org/10.1080/10412905.2010.9700324
. [all data]
Sharifiar, Yassa, et al., 2010
Sharifiar, F.; Yassa, N.; Mozaffarian, V.,
Bioactivity of major components from the seeds of Bunium persicum (Boiss.) Fedtch,
Pakistan J. Pharm. Sci., 2010, 23, 3, 300-304. [all data]
Xu, Tang, et al., 2010
Xu, X.; Tang, Z.; Liang, Y.,
Comparative analysis of plant essential oils by GC-MS coupled with integrated chemometric resolution methods,
Anal. Methods, 2010, 2, 4, 359-367, https://doi.org/10.1039/b9ay00213h
. [all data]
Li, Liang, et al., 2009
Li, X.-R.; Liang, Y.-Z.; Zhou, T.; Zhang, L.-X.; Hu, C.-D.,
Comparative analysis of volatile constituents between recipe jingfangsan and its single herbs by GC-MS combined with alternative moving window factor analysis method,
J. Sep. Sci., 2009, 32, 2, 258-266, https://doi.org/10.1002/jssc.200800574
. [all data]
Mendes, Trindade, et al., 2009
Mendes, M.D.; Trindade, H.; Figueiredo, A.C.; Pedro, L.G.; Barroso, J.G.,
Chaerophyllum azoricun Trel. grown in the Azores archipelago, Portugal: evaluation of the genetic diversity using molecular markers and comparison with volatile oils profiles,
Flavour Fragr. J., 2009, 24, 5, 259-265, https://doi.org/10.1002/ffj.1939
. [all data]
Chieng, Assim, et al., 2008
Chieng, T.C.; Assim, Z.B.; Fasihuddin, B.A.,
Toxicity and antitermite activities of the essential oils from Piper sarmentosum,
The Malaysian J. Anal. Sci., 2008, 12, 1, 234-239. [all data]
Zachariah, Leela, et al., 2008
Zachariah, T.J.; Leela, N.K.; Maya, K.M.; Rema, J.; Mathew, P.A.; Vipin, T.M.; Krishnamoorthy, B.,
Chemical composition of leaf oils of Myristica beddomeii (King), Myristica fragrans (Houtt.) and Myristica malabarica (Lamk.),
J. Spices Arom. Crops, 2008, 17, 1, 10-15. [all data]
Nivinsliene, Butkiene, et al., 2007
Nivinsliene, O.; Butkiene, R.; Gudalevic, A.; Mockute, D.; Meskauskiene, V.; Grigaliunaite, B.,
Influence of urban environment on chemical composition of Tilia cordata essential oil,
Chemija, 2007, 18, 1, 44-49. [all data]
Sharififar, Mozaffarian, et al., 2007
Sharififar, F.; Mozaffarian, V.; Moradkhani, S.,
Comparison of antioxidant and free radical scavenging activities of the essential oils from flowers and fruits of Otostegia persica Boiss.,
Pakistan J. Biol. Sci., 2007, 10, 21, 3895-3899, https://doi.org/10.3923/pjbs.2007.3895.3899
. [all data]
Singh, Marimuthu, et al., 2006
Singh, G.; Marimuthu, P.; de Heluani, C.S.; Catalan, C.A.N.,
Antioxidant and biocidal activities of Carum nigrum (seed) essential oil, oleoresin, and their selected components,
J. Agric. Food Chem., 2006, 54, 1, 174-181, https://doi.org/10.1021/jf0518610
. [all data]
Ansorena, Gimeno, et al., 2001
Ansorena, D.; Gimeno, O.; Astiasarán, I.; Bello, J.,
Analysis of volatile compounds by GC-MS of a dry fermented sausage: chorizo de Pamplona,
Food Res. Int., 2001, 34, 1, 67-75, https://doi.org/10.1016/S0963-9969(00)00133-2
. [all data]
Dorman, Figueiredo, et al., 2000
Dorman, H.J.D.; Figueiredo, A.C.; Barroso, J.G.; Deans, S.G.,
In vitro evaluation of antioxidant activity of essential oils and their components,
Flavour Fragr. J., 2000, 15, 1, 12-16, https://doi.org/10.1002/(SICI)1099-1026(200001/02)15:1<12::AID-FFJ858>3.0.CO;2-V
. [all data]
Pedro, da Silva, et al., 1999
Pedro, L.G.; da Silva, J.A.; Barroso, J.G.; Figueiredo, A.C.; Deans, S.G.; Looman, A.; Scheffer, J.J.C.,
Composition of the essential oil fo Chaerophyllum azoricum Trel., an endemic species of the Azores archipelago,
Flavour Fragr. J., 1999, 14, 5, 287-289, https://doi.org/10.1002/(SICI)1099-1026(199909/10)14:5<287::AID-FFJ827>3.0.CO;2-O
. [all data]
Santos, Figueiredo, et al., 1999
Santos, P.A.; Figueiredo, A.C.; Barroso, J.G.; Pedro, L.G.; Scheffer, J.J.C.,
Composition of the essential oil of Hypericum foliosum Aiton from five Azorean islands,
Flavour Fragr. J., 1999, 14, 5, 283-286, https://doi.org/10.1002/(SICI)1099-1026(199909/10)14:5<283::AID-FFJ826>3.0.CO;2-2
. [all data]
Masanetz and Grosch, 1998
Masanetz, C.; Grosch, W.,
Key odorants of parsley leaves (Petroselinum crispum [Mill.] Nym. ssp. crispum) by odour-activity values,
Flavour Fragr. J., 1998, 13, 2, 115-124, https://doi.org/10.1002/(SICI)1099-1026(199803/04)13:2<115::AID-FFJ706>3.0.CO;2-6
. [all data]
Figueiredo, Barroso, et al., 1997
Figueiredo, A.C.; Barroso, J.G.; Pedro, L.G.; Fontinha, S.S.; Looman, A.; Scheffer, J.J.C.,
Composition of the essential oil of Monizia edulis Lowe, an endemic species of the Madeira Archipelago,
Flavour Fragr. J., 1997, 12, 1, 29-31, https://doi.org/10.1002/(SICI)1099-1026(199701)12:1<29::AID-FFJ607>3.0.CO;2-K
. [all data]
Notes
Go To: Top, Normal alkane RI, non-polar column, custom temperature program, References
- Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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