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Submission id: GLS00094

Outputs for Kynurenic acid; EI-B; MS; 2 TMS; RT: 853.02 s


Database: GL Sciences Inc.
Entry ID: GLS00094
Synonyms: Kynurenic acid, Kynurenate
Total mass: 189.1672
Formula: H7 C10 O3 N1

Experimental information


MS type: MS
Instrument: GCMS-2010 Plus, Shimadzu
Instrument type: EI-B
Ionization mode: POSITIVE

CAMP general report:

Acceptable mass threshold: 2.0158
Out of range queried mass peaks: 192.9,195.9,199.0,202.0,205.0,208.0,211.0,214.0,217.0,220.0,223.0,226.0,229.05,232.05,235.0,238.0,241.0,244.0,247.0,250.0,253.0,256.0,258.05,260.1,263.1,266.1,269.1,272.0,274.95,277.0,280.0,283.0,286.05,289.05,292.0,295.0,298.0,301.0,303.15,306.0,309.0,312.0,315.0,317.05,320.05,323.0,326.0,329.0,331.1,334.05,336.1,339.1,342.1,345.1,349.1,352.1,355.1,358.1,361.1,364.1,368.1,371.1,374.1,378.1,381.1,384.1,387.1,390.1,393.1,396.1,399.1,402.1,405.1,408.1,413.1,416.1,419.1,423.1,426.1,429.1,432.1,435.1,438.1,441.1,445.1,448.1,451.1,455.1,458.1,461.1,464.1,467.1,470.1,473.1,476.1,479.1,482.1,485.1,488.1,491.1,494.1,497.1,
Replicated queried mass peaks: 87.0, 88.0, 90.0, 91.0, 92.8, 93.8, 95.8, 96.8, 98.6, 99.65, 101.55, 104.0, 106.0, 107.0, 109.45, 114.05, 115.0, 117.05, 118.0, 120.1, 122.45, 123.5, 125.5, 126.1, 128.05, 129.05, 131.0, 132.05, 134.0, 135.0, 137.4, 138.4, 140.0, 141.0, 142.65, 143.55, 145.9, 148.05, 149.0, 150.6, 151.6, 153.6, 156.0, 158.05, 159.05, 161.0, 162.0, 164.0, 165.0, 167.0, 168.0, 170.05, 171.0, 173.0, 174.0, 176.0, 177.0, 179.0, 180.0, 182.0, 183.0, 185.0, 186.0, 187.95, 188.9, 190.9, 191.9, 193.9, 194.9, 196.9, 197.9, 200.0, 200.95, 203.0, 204.0, 206.0, 207.0, 209.0, 210.0, 212.0, 213.0, 215.0, 216.0, 218.0, 218.95, 221.0, 222.0, 224.0, 225.0, 227.0, 228.0, 230.05, 231.05, 233.05, 234.0, 236.0, 237.0, 239.0, 240.0, 242.0, 243.0, 244.95, 246.0, 248.0, 249.0, 252.0, 254.0, 255.0, 257.0, 259.1, 261.1, 262.1, 264.1, 265.1, 267.1, 268.1, 270.1, 271.1, 273.0, 274.0, 276.0, 278.0, 279.0, 281.0, 282.0, 284.0, 285.0, 287.15, 288.05, 290.05, 291.05, 293.0, 294.0, 297.0, 299.0, 300.0, 302.0, 304.05, 305.05, 307.05, 308.0, 310.0, 311.0, 313.0, 314.0, 316.05, 318.05, 319.0, 320.95, 322.0, 324.0, 325.0, 327.0, 328.0, 330.0, 332.05, 333.05, 335.1, 337.1, 338.1, 340.1, 343.1, 344.1, 346.1, 347.1, 351.1, 353.1, 354.1, 357.1, 359.1, 360.1, 362.1, 363.1, 365.1, 366.1, 370.1, 372.1, 373.1, 375.1, 376.1, 380.1, 383.1, 385.1, 386.1, 388.1, 389.1, 391.1, 392.1, 394.1, 395.1, 397.1, 403.1, 404.1, 407.1, 409.1, 410.1, 414.1, 415.1, 417.1, 418.1, 420.1, 421.1, 424.1, 425.1, 427.1, 428.1, 430.1, 433.1, 434.1, 436.1, 437.1, 439.1, 440.1, 442.1, 443.1, 446.1, 447.1, 449.1, 450.1, 452.1, 453.1, 456.1, 457.1, 460.1, 462.1, 463.1, 466.1, 468.1, 469.1, 471.1, 472.1, 474.1, 475.1, 477.1, 478.1, 480.1, 481.1, 483.1, 487.1, 492.1, 493.1, 495.1, 496.1, 498.1, 499.1,
Processing time: 0:00:02.183688

Results for the quried mass "172.0"

FormulaMass differencesNum. used protonsNum. required extra protonsAtom names
C10O3 0.137 4 0 C1,C2,C3,C4,C5,C6,C7,C8,C9,C10,O12,O13,O14
C9O3N1 0.117 2 0 C2,C3,C4,C5,C6,C7,C8,C9,C10,N11,O12,O13,O14
C9O3N1 0.117 2 0 C1,C3,C4,C5,C6,C7,C8,C9,C10,N11,O12,O13,O14
C9O3N1 0.117 2 0 C1,C2,C4,C5,C6,C7,C8,C9,C10,N11,O12,O13,O14
C9O3N1 0.117 2 0 C1,C2,C3,C5,C6,C7,C8,C9,C10,N11,O12,O13,O14
C9O3N1 0.117 2 0 C1,C2,C3,C4,C6,C7,C8,C9,C10,N11,O12,O13,O14
C9O3N1 0.117 2 0 C1,C2,C3,C4,C5,C7,C8,C9,C10,N11,O12,O13,O14
C9O3N1 0.117 2 0 C1,C2,C3,C4,C5,C6,C8,C9,C10,N11,O12,O13,O14
C10O2N1 0.160 6 0 C1,C2,C3,C4,C5,C6,C7,C8,C9,C10,N11,O13,O14
C10O2N1 0.160 6 0 C1,C2,C3,C4,C5,C6,C7,C8,C9,C10,N11,O12,O14
C10O2N1 0.160 6 0 C1,C2,C3,C4,C5,C6,C7,C8,C9,C10,N11,O12,O13
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