CID 15716470

2-methyl-1-anthracenamine

Structural Information

Molecular Formula
C15H13N
SMILES
CC1=C(C2=CC3=CC=CC=C3C=C2C=C1)N
InChI
InChI=1S/C15H13N/c1-10-6-7-13-8-11-4-2-3-5-12(11)9-14(13)15(10)16/h2-9H,16H2,1H3
InChIKey
LNGNDIQVGYBPSM-UHFFFAOYSA-N
Compound name
2-methylanthracen-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

30
Patents

207.1048 Da
Monoisotopic Mass

4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 208.112076 143.1
[M+Na]+ 230.094018 153.9
[M-H]- 206.097524 149.0
[M+NH4]+ 225.138623 164.3
[M+K]+ 246.067958 148.3
[M+H-H2O]+ 190.102060 136.6
[M+HCOO]- 252.103001 167.2
[M+CH3COO]- 266.118651 157.2
[M+Na-2H]- 228.079466 152.8
[M]+ 207.10425142 143.6
[M]- 207.10534858 143.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe