CID 24278638

2-cyclopropyl-2,3-dihydro-1h-isoindol-4-amine dihydrochloride

Structural Information

Molecular Formula
C11H14N2
SMILES
C1CC1N2CC3=C(C2)C(=CC=C3)N
InChI
InChI=1S/C11H14N2/c12-11-3-1-2-8-6-13(7-10(8)11)9-4-5-9/h1-3,9H,4-7,12H2
InChIKey
BTCXFXOOPSRUDX-UHFFFAOYSA-N
Compound name
2-cyclopropyl-1,3-dihydroisoindol-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

174.11569 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 175.122966 136.6
[M+Na]+ 197.104908 146.7
[M-H]- 173.108414 143.3
[M+NH4]+ 192.149513 153.3
[M+K]+ 213.078848 142.0
[M+H-H2O]+ 157.112950 130.0
[M+HCOO]- 219.113891 159.2
[M+CH3COO]- 233.129541 149.9
[M+Na-2H]- 195.090356 141.9
[M]+ 174.11514142 136.2
[M]- 174.11623858 136.2
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

patents stripe