Matches any text strings used to describe a molecule.
Systematic Name, Synonym, Trade Name, Registry Number, SMILES, InChI or CSID

Systematic names 1,2-dihydroxybenzene
Synonyms AIBN
Trade names Aspirin
Registry numbers 7732-18-5
SMILES O=C(OCC)C
InChl InChI=1/CH4/h1H4
Search Hits Limit:
Single/Multi-component
Isotopically Labeled
Additional Filters

Found 37 results

Search term: MTCFGRXMJLQNBG (Found by InChIKey (skeleton match))
12
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
597


0 of 1 defined stereocentres - 0/1 defined
InChI=1/C3H7NO3/c4-2(1-5)3(6)7/h2,5H,1,4H2,(H,6,7)
C3H7NO3105.0926145642681283775
5736


1 of 1 defined stereocentres - 1/1 defined
InChI=1/C3H7NO3/c4-2(1-5)3(6)7/h2,5H,1,4H2,(H,6,7)/t2-/m0/s1
C3H7NO3105.092614236708681293858
64231

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C3H7NO3/c4-2(1-5)3(6)7/h2,5H,1,4H2,(H,6,7)/t2-/m1/s1
C3H7NO3105.09261318581714345
118192

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C3H7NO3/c4-2(1-5)3(6)7/h2,5H,1,4H2,(H,6,7)/t2-/m0/s1/i3+1
C213CH7NO3106.0852111200
21169756

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C3H7NO3/c4-2(1-5)3(6)7/h2,5H,1,4H2,(H,6,7)/t2-/m0/s1/i4+1
C3H715NO3106.086101000
21170332

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C3H7NO3/c4-2(1-5)3(6)7/h2,5H,1,4H2,(H,6,7)/i3+1
C213CH7NO3106.08526700
24533058

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C3H7NO3/c4-2(1-5)3(6)7/h2,5H,1,4H2,(H,6,7)/i1D2,2D
C3H4D3NO3108.11116617
8972020

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C3H7NO3/c4-2(1-5)3(6)7/h2,5H,1,4H2,(H,6,7)/t2-/m0/s1/i1+1
C213CH7NO3106.08526600
17341033

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C3H7NO3/c4-2(1-5)3(6)7/h2,5H,1,4H2,(H,6,7)/t2-/m0/s1/i2+1,4+1
C213CH715NO3107.07866600
32817095

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C3H7NO3/c4-2(1-5)3(6)7/h2,5H,1,4H2,(H,6,7)/t2-/m0/s1/i2+1
C213CH7NO3106.08524400
48061347

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C3H7NO3/c4-2(1-5)3(6)7/h2,5H,1,4H2,(H,6,7)/t2-/m0/s1/i1+1,2+1,3+1,4+1
13C3H715NO3109.0644400
49071248

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C3H7NO3/c4-2(1-5)3(6)7/h2,5H,1,4H2,(H,6,7)/t2-/m0/s1/i2+1,3+1
C13C2H7NO3107.07794400
8527113

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C3H7NO3/c4-2(1-5)3(6)7/h2,5H,1,4H2,(H,6,7)/t2-/m0/s1/i2D
C3H6DNO3106.09874400
2645702

Charge

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C3H7NO3/c4-2(1-5)3(6)7/h2,5H,1,4H2,(H,6,7)/p+1
C3H8NO3106.14600
4574241

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C3H7NO3/c4-2(1-5)3(6)7/h2,5H,1,4H2,(H,6,7)/p-1/t2-/m0/s1
C3H6NO3104.08523301
8488560

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C3H7NO3/c4-2(1-5)3(6)7/h2,5H,1,4H2,(H,6,7)/i2+1
C213CH7NO3106.08523300
24533063

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C3H7NO3/c4-2(1-5)3(6)7/h2,5H,1,4H2,(H,6,7)/t2-/m0/s1/i1D2,2D
C3H4D3NO3108.11113402
48061394

1 of 1 defined stereocentres - 1/1 defined

Non-standard isotope
InChI=1/C3H7NO3/c4-2(1-5)3(6)7/h2,5H,1,4H2,(H,6,7)/t2-/m0/s1/i1+1,2+1,3+1
13C3H7NO3108.07053300
17347301

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C3H7NO3/c4-2(1-5)3(6)7/h2,5H,1,4H2,(H,6,7)/i1+2,2+2,3+2
14C3H7NO3111.07023300
49071442

0 of 1 defined stereocentres - 0/1 defined

Non-standard isotope
InChI=1/C3H7NO3/c4-2(1-5)3(6)7/h2,5H,1,4H2,(H,6,7)/i4+1
C3H715NO3106.0862200
12
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