MassBank Record: UO000024

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2,6,10,14,18-Pentamethylicosane; EI-B; MS
Mass Spectrum
Chemical Structure
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ACCESSION: UO000024
RECORD_TITLE: 2,6,10,14,18-Pentamethylicosane; EI-B; MS
DATE: 2016.01.19 (2009.06.19, 2011.05.06)
AUTHORS: Hiroyuki Morii, Department of Environmental Management, and Chemistry, University of Occupational and Environmental Health
LICENSE: CC BY-SA
PUBLICATION: Morii, H., Yagi, H., Akutsu, H., Nomura, N., Sako, Y., and Koga, Y. 1999 A novel phosphoglycolipid archaetidyl(glucosyl)inositol with two sesterterpanyl chains from the aerobic hyperthermophilic archaeon Aeropyrum pernix K1 Biochim Biophys Acta. 1436 : 426-436
COMMENT: [Analytical] CHCL3 solution

CH$NAME: 2,6,10,14,18-Pentamethylicosane CH$COMPOUND_CLASS: Hydrocarbon CH$FORMULA: C25H52 CH$EXACT_MASS: 352.40690 CH$SMILES: CCC(C)CCCC(C)CCCC(C)CCCC(C)CCCC(C)C CH$IUPAC: InChI=1S/C25H52/c1-8-22(4)14-10-16-24(6)18-12-20-25(7)19-11-17-23(5)15-9-13-21(2)3/h21-25H,8-20H2,1-7H3 CH$LINK: CAS 51794-16-2 CH$LINK: NIKKAJI J100.980J CH$LINK: INCHIKEY SJBLBJCIOBWHAC-UHFFFAOYSA-N CH$LINK: PUBCHEM CID:521349
AC$INSTRUMENT: JEOL AX-505HA AC$INSTRUMENT_TYPE: EI-B AC$MASS_SPECTROMETRY: MS_TYPE MS AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-0abj-9510000000-6010401e1b1b0a558a82 PK$NUM_PEAK: 102 PK$PEAK: m/z int. rel.int. 32.0 44 44 35.7 22 22 37.7 7 7 38.9 13 13 40.2 4 4 41.2 175 175 42.0 42 42 43.0 483 483 43.6 16 16 52.9 6 6 53.8 6 6 55.3 242 242 56.3 216 216 57.0 999 999 58.0 59 59 67.0 19 19 68.0 19 19 69.2 198 198 70.4 204 204 72.0 949 949 73.0 66 66 81.2 15 15 82.3 12 12 83.3 109 109 84.2 104 104 86.0 677 677 86.5 52 52 95.0 13 13 96.2 79 79 97.4 182 182 98.1 69 69 99.8 353 353 100.0 29 29 109.1 5 5 110.1 13 13 111.3 79 79 112.4 208 208 113.8 416 416 114.0 40 40 124.1 9 9 125.3 66 66 126.6 225 225 127.0 431 431 128.0 48 48 138.2 1 1 139.2 17 17 140.1 58 58 141.3 241 241 142.0 27 27 153.1 5 5 154.3 56 56 155.5 201 201 156.2 25 25 167.1 22 22 168.3 48 48 169.6 176 176 170.2 24 24 181.1 8 8 182.4 170 170 183.5 317 317 184.0 50 50 195.0 4 4 196.4 162 162 197.0 311 311 198.3 50 50 199.0 4 4 210.3 14 14 211.4 62 62 212.0 10 10 224.1 48 48 225.2 81 81 225.8 14 14 238.2 46 46 239.3 70 70 240.0 13 13 252.5 116 116 253.3 185 185 254.5 37 37 255.1 3 3 266.5 97 97 267.0 171 171 268.0 34 34 269.0 3 3 280.2 15 15 281.1 21 21 282.0 4 4 294.1 9 9 295.2 20 20 296.3 4 4 308.0 9 9 309.3 16 16 310.1 2 2 322.5 27 27 323.0 62 62 324.4 15 15 336.1 9 9 337.2 57 57 337.8 14 14 350.4 1 1 352.4 140 140 353.2 39 39 353.8 5 5 //