CID 3286613

2-(1-methylcyclopropyl)aniline hydrochloride

Structural Information

Molecular Formula
C10H13N
SMILES
CC1(CC1)C2=CC=CC=C2N
InChI
InChI=1S/C10H13N/c1-10(6-7-10)8-4-2-3-5-9(8)11/h2-5H,6-7,11H2,1H3
InChIKey
OEFXKZHXLSCUEQ-UHFFFAOYSA-N
Compound name
2-(1-methylcyclopropyl)aniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

12
Patents

147.1048 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 148.11208 132.7
[M+Na]+ 170.09402 147.1
[M+NH4]+ 165.13862 144.5
[M+K]+ 186.06796 139.7
[M-H]- 146.09752 144.5
[M+Na-2H]- 168.07947 145.3
[M]+ 147.10425 139.4
[M]- 147.10535 139.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe