CID 62489809

4-cyclopropyl-3-methylaniline

Structural Information

Molecular Formula
C10H13N
SMILES
CC1=C(C=CC(=C1)N)C2CC2
InChI
InChI=1S/C10H13N/c1-7-6-9(11)4-5-10(7)8-2-3-8/h4-6,8H,2-3,11H2,1H3
InChIKey
ANNKRWAGEJSSIF-UHFFFAOYSA-N
Compound name
4-cyclopropyl-3-methylaniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

147.1048 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 148.11208 130.8
[M+Na]+ 170.09402 145.3
[M+NH4]+ 165.13862 141.2
[M+K]+ 186.06796 139.7
[M-H]- 146.09752 142.4
[M+Na-2H]- 168.07947 141.8
[M]+ 147.10425 137.3
[M]- 147.10535 137.3
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