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Input Parameter NameParameter Value(s)
# Reactions1
Ion TypeNeutral
Query Mass168.0426061 Da
Neutral Mass168.042606 Da
Mass Tolerance±15 ppm



#HMDB IDCommon NameMass (Da) Formula Chemical Structure Explore
(for Firefox)
Possible Reactions Reaction
Offset (Da)
Mass Error (ppm)To DelAttachments
1 HMDB00020 p-Hydroxyphenylacetic acid 152.047345 C8H8O3 Structure ChemDraw Pro

ChemDraw Plugin
[+O]15.99491502.059597
2 HMDB00118 Homovanillic acid 182.05791 C9H10O4 Structure ChemDraw Pro

ChemDraw Plugin
[-CH2]-14.01565002.059597
3 HMDB00152 Gentisic acid 154.02661 C7H6O4 Structure ChemDraw Pro

ChemDraw Plugin
[+CH2]14.01565002.059597
4 HMDB00318 3,4-Dihydroxyphenylglycol 170.05791 C8H10O4 Structure ChemDraw Pro

ChemDraw Plugin
[-H2]-2.015650002.059597
5 HMDB00333 Isohomovanillic acid 182.05791 C9H10O4 Structure ChemDraw Pro

ChemDraw Plugin
[-CH2]-14.01565002.059597
6 HMDB00397 2-Pyrocatechuic acid 154.02661 C7H6O4 Structure ChemDraw Pro

ChemDraw Plugin
[+CH2]14.01565002.059597
7 HMDB00440 3-Hydroxyphenylacetic acid 152.047345 C8H8O3 Structure ChemDraw Pro

ChemDraw Plugin
[+O]15.99491502.059597
8 HMDB00669 Ortho-Hydroxyphenylacetic acid 152.047345 C8H8O3 Structure ChemDraw Pro

ChemDraw Plugin
[+O]15.99491502.059597
9 HMDB00703 Mandelic acid 152.047345 C8H8O3 Structure ChemDraw Pro

ChemDraw Plugin
[+O]15.99491502.059597
10 HMDB00873 4-Methylcatechol 124.05243 C7H8O2 Structure ChemDraw Pro

ChemDraw Plugin
[+CO2]43.98983002.059597
11 HMDB01101 p-Anisic acid 152.047345 C8H8O3 Structure ChemDraw Pro

ChemDraw Plugin
[+O]15.99491502.059597
12 HMDB01398 Guaiacol 124.05243 C7H8O2 Structure ChemDraw Pro

ChemDraw Plugin
[+CO2]43.98983002.059597
13 HMDB01587 Phenylglyoxylic acid 150.031695 C8H6O3 Structure ChemDraw Pro

ChemDraw Plugin
[+H2O]18.01056502.059597
14 HMDB01856 Protocatechuic acid 154.02661 C7H6O4 Structure ChemDraw Pro

ChemDraw Plugin
[+CH2]14.01565002.059597
15 HMDB01866 3,4-Dihydroxymandelic acid 184.037175 C8H8O5 Structure ChemDraw Pro

ChemDraw Plugin
[-O]-15.99491502.059597
16 HMDB02107 Phthalic acid 166.02661 C8H6O4 Structure ChemDraw Pro

ChemDraw Plugin
[+H2]2.015650002.059597
17 HMDB02334 Benzoquinoneacetic acid 166.02661 C8H6O4 Structure ChemDraw Pro

ChemDraw Plugin
[+H2]2.015650002.059597
18 HMDB02390 3-Cresotinic acid 152.047345 C8H8O3 Structure ChemDraw Pro

ChemDraw Plugin
[+O]15.99491502.059597
19 HMDB02428 Terephthalic acid 166.02661 C8H6O4 Structure ChemDraw Pro

ChemDraw Plugin
[+H2]2.015650002.059597
20 HMDB03791 3,4-Dihydroxyphenylacetaldehyde 152.047345 C8H8O3 Structure ChemDraw Pro

ChemDraw Plugin
[+O]15.99491502.059597
21 HMDB04061 3-Methoxy-4-hydroxyphenylglycolaldehyde 182.05791 C9H10O4 Structure ChemDraw Pro

ChemDraw Plugin
[-CH2]-14.01565002.059597
22 HMDB04815 4-Hydroxy-3-methylbenzoic acid 152.047345 C8H8O3 Structure ChemDraw Pro

ChemDraw Plugin
[+O]15.99491502.059597
23 HMDB11724 4-Hydroxybenzyl alcohol 124.05243 C7H8O2 Structure ChemDraw Pro

ChemDraw Plugin
[+CO2]43.98983002.059597
24 HMDB12308 Vanillin 152.047345 C8H8O3 Structure ChemDraw Pro

ChemDraw Plugin
[+O]15.99491502.059597


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