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

6
Patents

174.11569 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 175.12297 136.6
[M+Na]+ 197.10491 146.7
[M-H]- 173.10841 143.3
[M+NH4]+ 192.14951 153.3
[M+K]+ 213.07885 142.0
[M+H-H2O]+ 157.11295 130.0
[M+HCOO]- 219.11389 159.2
[M+CH3COO]- 233.12954 149.9
[M+Na-2H]- 195.09036 141.9
[M]+ 174.11514 136.2
[M]- 174.11624 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