CID 28818869

N-cyclopropyl-4-[(cyclopropylamino)methyl]benzamide

Structural Information

Molecular Formula
C14H18N2O
SMILES
C1CC1NCC2=CC=C(C=C2)C(=O)NC3CC3
InChI
InChI=1S/C14H18N2O/c17-14(16-13-7-8-13)11-3-1-10(2-4-11)9-15-12-5-6-12/h1-4,12-13,15H,5-9H2,(H,16,17)
InChIKey
YHORWKMCXKFICF-UHFFFAOYSA-N
Compound name
N-cyclopropyl-4-[(cyclopropylamino)methyl]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

230.1419 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 231.14918 151.9
[M+Na]+ 253.13112 157.5
[M-H]- 229.13462 161.1
[M+NH4]+ 248.17572 158.3
[M+K]+ 269.10506 154.6
[M+H-H2O]+ 213.13916 145.5
[M+HCOO]- 275.14010 174.2
[M+CH3COO]- 289.15575 205.9
[M+Na-2H]- 251.11657 155.7
[M]+ 230.14135 154.0
[M]- 230.14245 154.0
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.