CID 23282

6844-32-2

Structural Information

Molecular Formula
C11H15N2
SMILES
C[N+](C)(C)C1=CC2=C(C=C1)NC=C2
InChI
InChI=1S/C11H15N2/c1-13(2,3)10-4-5-11-9(8-10)6-7-12-11/h4-8,12H,1-3H3/q+1
InChIKey
IZJOSSRTUVQRCU-UHFFFAOYSA-N
Compound name
1H-indol-5-yl(trimethyl)azanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

12
Patents

175.12352 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 176.13080 135.2
[M+Na]+ 198.11274 144.5
[M-H]- 174.11624 139.4
[M+NH4]+ 193.15734 157.1
[M+K]+ 214.08668 135.9
[M+H-H2O]+ 158.12078 132.2
[M+HCOO]- 220.12172 158.9
[M+CH3COO]- 234.13737 176.8
[M+Na-2H]- 196.09819 147.0
[M]+ 175.12297 134.9
[M]- 175.12407 134.9
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