MassBank Record: JP000139



 CERVICARCIN; FD-B; MS 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: JP000139
RECORD_TITLE: CERVICARCIN; FD-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: FUKUSHIMA K, INST. FOR CHEMOBIODYNAMICS, CHIBA UNIV.
LICENSE: CC BY-NC-SA

CH$NAME: CERVICARCIN CH$COMPOUND_CLASS: N/A CH$FORMULA: C19H20O9 CH$EXACT_MASS: 392.11073 CH$SMILES: CC(O1)C1C(=O)C(O)(C(C)3)C(O)C(C(O)4)(O2)C(C(=O)c(c5)c(c(O)cc5)4)(C(O)3)2 CH$IUPAC: InChI=1S/C19H20O9/c1-6-12(21)18-13(22)8-4-3-5-9(20)10(8)14(23)19(18,28-18)16(25)17(6,26)15(24)11-7(2)27-11/h3-7,11-12,14,16,20-21,23,25-26H,1-2H3
AC$INSTRUMENT: Unknown AC$INSTRUMENT_TYPE: FD-B AC$MASS_SPECTROMETRY: MS_TYPE MS AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-0006-0009000000-da8bad7164d882e63056 PK$NUM_PEAK: 21 PK$PEAK: m/z int. rel.int. 115 10.22 102 127 5.36 54 188 2.14 21 257 1.31 13 283 1.85 19 288 1.23 12 299 1.35 14 306 5.34 53 307 1.54 15 332 2.81 28 334 1.38 14 336 1.76 18 356 6.79 68 359 1.97 20 362 1.88 19 374 1.81 18 389 4.48 45 392 99.99 999 393 19.07 191 394 9.87 99 395 1.71 17 //