CID 43370190

2-propyl-2,3-dihydro-1h-isoindol-4-amine

Structural Information

Molecular Formula
C11H16N2
SMILES
CCCN1CC2=C(C1)C(=CC=C2)N
InChI
InChI=1S/C11H16N2/c1-2-6-13-7-9-4-3-5-11(12)10(9)8-13/h3-5H,2,6-8,12H2,1H3
InChIKey
JBIZIGZHQMDVHR-UHFFFAOYSA-N
Compound name
2-propyl-1,3-dihydroisoindol-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

176.13135 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 177.13863 139.2
[M+Na]+ 199.12057 147.2
[M-H]- 175.12407 141.9
[M+NH4]+ 194.16517 160.9
[M+K]+ 215.09451 143.8
[M+H-H2O]+ 159.12861 132.8
[M+HCOO]- 221.12955 161.5
[M+CH3COO]- 235.14520 184.1
[M+Na-2H]- 197.10602 144.0
[M]+ 176.13080 137.5
[M]- 176.13190 137.5
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.