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Substance Name: Petrolite E 1040
RN: 114013-51-3
InChIKey: JUVHVMCKLDZLGN-TVNFHGJBSA-N

Molecular Weight

  • 550.6184
 
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Names and Synonyms

Synonym

  • E 1040

Systematic Name

  • Petrolite E 1040

Registry Numbers

CAS Registry Number

  • 114013-51-3

System Generated Number

  • 0114013513

Structure Descriptors

InChI

1S/C21H26N8O6S2/c1-35-26-11(14-25-20(23)37-27-14)15(30)24-12-16(31)28-13(18(32)33)10(9-36-17(12)28)8-29-5-2-21(3-6-29,4-7-29)19(22)34/h12,17H,2-9H2,1H3,(H5-,22,23,24,25,27,30,32,33,34)/b26-11-/t12-,17-,21?,29?/m1/s1

InChIKey

JUVHVMCKLDZLGN-TVNFHGJBSA-N

Smiles

N12C([C@H](NC(C(\c3nc(N)sn3)=N\OC)=O)[C@H]1SCC(=C2C([O-])=O)C[N+]12CCC(CC2)(C(=O)N)CC1)=O