CID 9574915

Schembl20143321

Structural Information

Molecular Formula
C10H19N3O
SMILES
CC(C)/C=N/NC(=O)C1CCNCC1
InChI
InChI=1S/C10H19N3O/c1-8(2)7-12-13-10(14)9-3-5-11-6-4-9/h7-9,11H,3-6H2,1-2H3,(H,13,14)/b12-7+
InChIKey
QMTNZGPFXHIQII-KPKJPENVSA-N
Compound name
N-[(E)-2-methylpropylideneamino]piperidine-4-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

1
Patents

197.15282 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 198.16010 147.8
[M+Na]+ 220.14204 150.1
[M-H]- 196.14554 148.7
[M+NH4]+ 215.18664 164.6
[M+K]+ 236.11598 148.8
[M+H-H2O]+ 180.15008 140.3
[M+HCOO]- 242.15102 167.0
[M+CH3COO]- 256.16667 188.6
[M+Na-2H]- 218.12749 150.7
[M]+ 197.15227 141.3
[M]- 197.15337 141.3
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

No patent data available for this compound.