CID 83212956

1-benzyl-5-methyl-2,3-dihydro-1h-indol-6-amine

Structural Information

Molecular Formula
C16H18N2
SMILES
CC1=CC2=C(C=C1N)N(CC2)CC3=CC=CC=C3
InChI
InChI=1S/C16H18N2/c1-12-9-14-7-8-18(16(14)10-15(12)17)11-13-5-3-2-4-6-13/h2-6,9-10H,7-8,11,17H2,1H3
InChIKey
DLNRGPUZNKHOBG-UHFFFAOYSA-N
Compound name
1-benzyl-5-methyl-2,3-dihydroindol-6-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

238.147 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 239.154276 155.3
[M+Na]+ 261.136218 163.4
[M-H]- 237.139724 161.3
[M+NH4]+ 256.180823 174.2
[M+K]+ 277.110158 158.0
[M+H-H2O]+ 221.144260 147.5
[M+HCOO]- 283.145201 177.3
[M+CH3COO]- 297.160851 167.6
[M+Na-2H]- 259.121666 159.0
[M]+ 238.14645142 153.2
[M]- 238.14754858 153.2
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

No patent data available for this compound.