CID 31633

Acridinium, 3-amino-10-methyl-, bromide

Structural Information

Molecular Formula
C14H13N2
SMILES
C[N+]1=C2C=C(C=CC2=CC3=CC=CC=C31)N
InChI
InChI=1S/C14H12N2/c1-16-13-5-3-2-4-10(13)8-11-6-7-12(15)9-14(11)16/h2-9,15H,1H3/p+1
InChIKey
NJLGSVSVNHBQEG-UHFFFAOYSA-O
Compound name
10-methylacridin-10-ium-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

209.10788 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 210.11516 145.2
[M+Na]+ 232.09710 156.1
[M-H]- 208.10060 150.1
[M+NH4]+ 227.14170 164.6
[M+K]+ 248.07104 145.2
[M+H-H2O]+ 192.10514 140.6
[M+HCOO]- 254.10608 168.0
[M+CH3COO]- 268.12173 184.9
[M+Na-2H]- 230.08255 157.6
[M]+ 209.10733 144.8
[M]- 209.10843 144.8
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