CID 275807

9,10-dihydro-9,10-ethanoanthracene-11,12-dicarboxylic dihydrazide

Structural Information

Molecular Formula
C18H18N4O2
SMILES
C1=CC=C2C3C(C(C(C2=C1)C4=CC=CC=C34)C(=O)NN)C(=O)NN
InChI
InChI=1S/C18H18N4O2/c19-21-17(23)15-13-9-5-1-2-6-10(9)14(16(15)18(24)22-20)12-8-4-3-7-11(12)13/h1-8,13-16H,19-20H2,(H,21,23)(H,22,24)
InChIKey
VSIXZNXJYWMUMM-UHFFFAOYSA-N
Compound name
tetracyclo[6.6.2.02,7.09,14]hexadeca-2,4,6,9,11,13-hexaene-15,16-dicarbohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

31
Patents

322.14297 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 323.15025 166.7
[M+Na]+ 345.13219 169.7
[M-H]- 321.13569 167.7
[M+NH4]+ 340.17679 183.7
[M+K]+ 361.10613 166.5
[M+H-H2O]+ 305.14023 159.2
[M+HCOO]- 367.14117 181.3
[M+CH3COO]- 381.15682 175.0
[M+Na-2H]- 343.11764 175.4
[M]+ 322.14242 164.8
[M]- 322.14352 164.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe