Cyclohexanone, 5-methyl-2-(1-methylethyl)-, cis-
- Formula: C10H18O
- Molecular weight: 154.2493
- IUPAC Standard InChI: InChI=1S/C10H18O/c1-7(2)9-5-4-8(3)6-10(9)11/h7-9H,4-6H2,1-3H3/t8-,9-/m1/s1
- IUPAC Standard InChIKey: NFLGAXVYCFJBMK-RKDXNWHRSA-N
- CAS Registry Number: 491-07-6
- Chemical structure:
This structure is also available as a 2d Mol file or as a computed 3d SD file
The 3d structure may be viewed using Java or Javascript. - Species with the same structure:
- Stereoisomers:
- Other names: p-Menthan-3-one, cis-; cis-p-Menthan-3-one; Isomenthone; p-Menthan-3-one, (Z)-; Cyclohexanone, 5-methyl-2-(1-methylethyl)-, (Z)-; 2-Isopropyl-5-methyl-cyclohexanone, cis; 5-Methyl-2-(1-methylethyl)cyclohexanone, (Z)-; α-Isomenthone; cis-5-Methyl-2-(1-methylethyl)-cyclohexanone; Isomenthon; cis-Menthone; cis-p-Menthone; (2R,5R)-2-isopropyl-5-methylcyclohexanone, rel-; Cyclohexanone, 5-methyl-2-(1-methylethyl)-, (2R,5R)-rel-; dl-Isomenthone
- Information on this page:
- Other data available:
- Options:
Normal alkane RI, non-polar column, temperature ramp
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 | HP-5 MS | HP-5 | HP-5 MS | OV-101 |
| Column length (m) | 30. | 30. | 30. | 30. | 50. |
| Carrier gas | Helium | Helium | 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 | 0.25 |
| Tstart (C) | 60. | 30. | 50. | 100. | 70. |
| Tend (C) | 240. | 250. | 240. | 220. | 220. |
| Heat rate (K/min) | 3. | 5. | 3. | 2. | 2. |
| Initial hold (min) | 3. | 5. | |||
| Final hold (min) | 10. | ||||
| I | 1163. | 1197. | 1162. | 1162. | 1153. |
| Reference | Bertoli, Lepnardi, et al., 2011 | Zarai, Kadri, et al., 2011 | Monsef-Esfahani, Miri, et al., 2010 | Pripdeevech, Chumpolsri, et al., 2010 | Benites, Moiteiro, et al., 2009 |
| Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
| Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
|---|---|---|---|---|---|
| Active phase | DB-5 MS | DB-5 | CP Sil 5 CB | DB-5 | CP Sil 5 CB |
| Column length (m) | 30. | 50. | 30. | 30. | 30. |
| Carrier gas | Helium | He | N2 | He | N2 |
| Substrate | |||||
| Column diameter (mm) | 0.25 | 0.32 | 0.32 | 0.25 | 0.25 |
| Phase thickness (μm) | 0.25 | 0.25 | 0.25 | 0.25 | 0.25 |
| Tstart (C) | 40. | 50. | 60. | 70. | 50. |
| Tend (C) | 250. | 280. | 300. | 310. | 200. |
| Heat rate (K/min) | 4. | 5. | 4. | 3. | 5. |
| Initial hold (min) | 2. | 2. | 5. | ||
| Final hold (min) | 2. | 10. | 20. | ||
| I | 1170. | 1176. | 1148. | 1141. | 1150. |
| Reference | Su, Wang, et al., 2009 | Baranauskiene R., Bylaite E., et al., 2007 | Baran, von Reuss, et al., 2007 | Coelho, Grosso, et al., 2007 | Hnawia, Cabalion, 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 | HP-5 MS | DB-5 | PE-5 | HP-5MS |
| Column length (m) | 30. | 30. | 30. | 30. | 30. |
| Carrier gas | Helium | Helium | He | H2 | He |
| Substrate | |||||
| Column diameter (mm) | 0.25 | 0.25 | 0.25 | 0.32 | 0.25 |
| Phase thickness (μm) | 0.25 | 0.25 | 0.25 | 0.25 | 0.25 |
| Tstart (C) | 40. | 60. | 40. | 60. | 60. |
| Tend (C) | 260. | 280. | 250. | 230. | 280. |
| Heat rate (K/min) | 4. | 3. | 4. | 5. | 3. |
| Initial hold (min) | 2. | ||||
| Final hold (min) | 4. | ||||
| I | 1150. | 1163. | 1137. | 1185. | 1164. |
| Reference | Ristic, Krivokuca-Dokic, et al., 2007 | Vagionas, Graikou, et al., 2007 | Yadegarinia, Gachkar, et al., 2006 | Singh, Raina, et al., 2005 | Slavkovska, Couladis, et al., 2005 |
| Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
| Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
|---|---|---|---|---|---|
| Active phase | HP-5MS | BPX-5 | DB-5 | DB-5 | BP-1 |
| Column length (m) | 30. | 25. | 60. | 30. | 30. |
| Carrier gas | He | He | He | He | N2 |
| Substrate | |||||
| Column diameter (mm) | 0.25 | 0.22 | 0.32 | 0.25 | 0.25 |
| Phase thickness (μm) | 0.25 | 1. | 0.25 | 0.25 | |
| Tstart (C) | 60. | 60. | 50. | 70. | 60. |
| Tend (C) | 280. | 250. | 220. | 250. | 220. |
| Heat rate (K/min) | 3. | 3. | 3. | 3. | 5. |
| Initial hold (min) | 5. | 3. | |||
| Final hold (min) | 10. | 2. | |||
| I | 1167. | 1186. | 1176. | 1134. | 1148. |
| Reference | Mimica-Dukic, Bozin, et al., 2004 | Vilaseca, Guy, et al., 2004 | Edris and Farrag, 2003 | Phatak and Heble, 2002 | Gupta, Mallavarapu, et al., 2001 |
| Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
| Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
|---|---|---|---|---|---|
| Active phase | OV-101 | HP-5 | HP-1 | OV-1 | BP-1 |
| Column length (m) | 50. | 30. | 25. | 25. | 25. |
| Carrier gas | He | He | H2 | H2 | N2 |
| Substrate | |||||
| Column diameter (mm) | 0.2 | 0.25 | 0.32 | 0.25 | 0.5 |
| Phase thickness (μm) | 0.17 | 0.25 | |||
| Tstart (C) | 50. | 80. | 40. | 40. | 60. |
| Tend (C) | 250. | 200. | 260. | 220. | 220. |
| Heat rate (K/min) | 2. | 9. | 3. | 3. | 5. |
| Initial hold (min) | 5. | 5. | |||
| Final hold (min) | 10. | 5. | 10. | ||
| I | 1142. | 1155. | 1132. | 1151. | 1149. |
| Reference | Orav and Kann, 2001 | Lis-Balchin and Roth, 2000 | Lopes, Koketsu, et al., 1999 | Oberhofer, Nikiforov, et al., 1999 | Rao, Bhattacharya, et al., 1999 |
| Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
| Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
|---|---|---|---|---|---|
| Active phase | DB-5 | OV-101 | OV-101 | SE-30+Igepal | SE-30+Igepal |
| Column length (m) | 30. | 30. | 30. | 100. | 100. |
| Carrier gas | He | He | He | ||
| Substrate | |||||
| Column diameter (mm) | 0.25 | 0.5 | 0.5 | 0.25 | 0.25 |
| Phase thickness (μm) | 0.25 | 0.8 | 0.8 | ||
| Tstart (C) | 50. | 40. | 40. | 70. | 70. |
| Tend (C) | 250. | 220. | 220. | 170. | 170. |
| Heat rate (K/min) | 2. | 2. | 2. | 1. | 1. |
| Initial hold (min) | 5. | ||||
| Final hold (min) | |||||
| I | 1133. | 1143. | 1143. | 1155. | 1155. |
| Reference | Reverchon, Porta, et al., 1997 | De Pooter and Schamp, 1986 | De Pooter and Schamp, 1986 | Shibamoto and Jennings, 1977 | Shibamoto and Jennings, 1977 |
| Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
References
Go To: Top, Normal alkane RI, non-polar column, temperature ramp, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
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Notes
Go To: Top, Normal alkane RI, non-polar column, temperature ramp, References
- Symbols used in this document:
Tend Final temperature Tstart Initial temperature - Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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