CID 232646

9,10-bis-(formamido)-anthracene

Structural Information

Molecular Formula
C16H12N2O2
SMILES
C1=CC=C2C(=C1)C(=C3C=CC=CC3=C2NC=O)NC=O
InChI
InChI=1S/C16H12N2O2/c19-9-17-15-11-5-1-2-6-12(11)16(18-10-20)14-8-4-3-7-13(14)15/h1-10H,(H,17,19)(H,18,20)
InChIKey
PYSPQAXLYSCIOC-UHFFFAOYSA-N
Compound name
N-(10-formamidoanthracen-9-yl)formamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

264.08987 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 265.09715 154.4
[M+Na]+ 287.07909 164.0
[M-H]- 263.08259 160.5
[M+NH4]+ 282.12369 172.7
[M+K]+ 303.05303 158.8
[M+H-H2O]+ 247.08713 146.8
[M+HCOO]- 309.08807 180.5
[M+CH3COO]- 323.10372 167.5
[M+Na-2H]- 285.06454 165.2
[M]+ 264.08932 157.0
[M]- 264.09042 157.0
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