CID 174075

65003-32-9

Structural Information

Molecular Formula
C15H18N4O3
SMILES
COC(=O)NC1=NC2=C(N1)C=C(C=C2)C(=O)N3CCCCC3
InChI
InChI=1S/C15H18N4O3/c1-22-15(21)18-14-16-11-6-5-10(9-12(11)17-14)13(20)19-7-3-2-4-8-19/h5-6,9H,2-4,7-8H2,1H3,(H2,16,17,18,21)
InChIKey
BQBMJMKDJQOLCK-UHFFFAOYSA-N
Compound name
methyl N-[6-(piperidine-1-carbonyl)-1H-benzimidazol-2-yl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

0
Patents

302.13788 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 303.14516 168.9
[M+Na]+ 325.12710 178.9
[M+NH4]+ 320.17170 174.3
[M+K]+ 341.10104 176.2
[M-H]- 301.13060 169.7
[M+Na-2H]- 323.11255 173.2
[M]+ 302.13733 170.0
[M]- 302.13843 170.0
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

No patent data available for this compound.